4-(5-Methoxy-2,3,3-trimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate, 95%

cas: 54136-27-5 — see every product listed under this CAS number, including other names

4-(5-Methoxy-2,3,3-trimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate, 95% (CAS 54136-27-5) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 250mg, 1g. Offered by: Chemat.

• 2D
• 3D

4-(5-methoxy-2,3,3-trimethylindol-1-ium-1-yl)butane-1-sulfonate (CAS 54136-27-5) is a chemical compound with the molecular formula C16H23NO4S and a molecular weight of 325.4 g/mol. IUPAC name: 4-(5-methoxy-2,3,3-trimethylindol-1-ium-1-yl)butane-1-sulfonate. InChIKey: PVYCRNUCAJPUFN-UHFFFAOYSA-N.

Identity

Molecular formula	C16H23NO4S
Molecular weight	325.4 g/mol
IUPAC name	4-(5-methoxy-2,3,3-trimethylindol-1-ium-1-yl)butane-1-sulfonate
InChIKey	PVYCRNUCAJPUFN-UHFFFAOYSA-N
SMILES	CC1=[N+](C2=C(C1(C)C)C=C(C=C2)OC)CCCCS(=O)(=O)[O-]

Computed by PubChem (NCBI)

Synonyms: 4-(5-Methoxy-2,3,3-trimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate, 5-Methoxy-2,3,3-trimethyl-1-(4-sulfobutyl)-indolium inner salt, 4-(5-methoxy-2,3,3-trimethylindol-1-ium-1-yl)butane-1-sulfonate, 5-methoxy-2,3,3-trimethyl-1-(4-sulfonatobutyl)-3H-indol-1-ium, 4-(5-Methoxy-2,3,3-trimethyl-3H-indol-1-ium-1-yl)butane-1-sulfote

Isomers (same molecular formula)

methyl (2S)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate C₁₆H₂₃NO₄S

1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxylic acid C₁₆H₂₃NO₄S

1-(4-tert-butylphenyl)sulfonylpiperidine-4-carboxylic acid C₁₆H₂₃NO₄S

(2S)-3-[(4-methylphenyl)methylsulfanyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid C₁₆H₂₃NO₄S

tert-butyl N-[(2R)-4-(4-methylphenyl)sulfinyl-3-oxobutan-2-yl]carbamate C₁₆H₂₃NO₄S

tert-butyl 2-(4-methylsulfonylphenyl)pyrrolidine-1-carboxylate C₁₆H₂₃NO₄S

methyl (2R)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate C₁₆H₂₃NO₄S

3-O-tert-butyl 5-O-ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3,5-dicarboxylate C₁₆H₂₃NO₄S

3-O-tert-butyl 7-O-ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3,7-dicarboxylate C₁₆H₂₃NO₄S

octyl 2-(4-nitrophenyl)sulfanylacetate C₁₆H₂₃NO₄S

(2-benzyl-6-oxa-2-azaspiro[4.5]decan-9-yl) methanesulfonate C₁₆H₂₃NO₄S

ethyl 5,5-dimethyl-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate C₁₆H₂₃NO₄S