(1R,3R)-Methyl 1-(benzo[d][1,3]dioxol-5-yl)-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, 95%

cas: 171489-59-1 — see every product listed under this CAS number, including other names

(1R,3R)-Methyl 1-(benzo[d][1,3]dioxol-5-yl)-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, 95% (CAS 171489-59-1) is a chemical reagent available from Chemat. Available pack sizes: 1g, 5g, 10g, 25g, 100g, 500g, 1kg. Offered by: BLDpharm.

• 2D
• 3D

Methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate (CAS 171489-59-1) is a chemical compound with the molecular formula C22H19ClN2O5 and a molecular weight of 426.8 g/mol. IUPAC name: methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate. InChIKey: JUKHNCNDFOAFLT-IIBYNOLFSA-N.

Identity

Molecular formula	C22H19ClN2O5
Molecular weight	426.8 g/mol
IUPAC name	methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate
InChIKey	JUKHNCNDFOAFLT-IIBYNOLFSA-N
SMILES	COC(=O)[C@H]1CC2=C([C@H](N1C(=O)CCl)C3=CC4=C(C=C3)OCO4)NC5=CC=CC=C25

Computed by PubChem (NCBI)

Synonyms: Chloropretadalafil, rel-Chloropretadalafil, C22H19ClN2O5, Tadalafil Impurity 17, Tadalafil Impurity 37, 2,5-dimethoxy, (Chloropretadalafil), orb3143675, JUKHNCNDFOAFLT-IIBYNOLFSA-N

Related forms of this compound

methyl (1R,3S)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C₂₂H₁₉ClN₂O₅

methyl (1S,3S)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C₂₂H₁₉ClN₂O₅

methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C₂₂H₁₉ClN₂O₅

methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C₂₂H₁₉ClN₂O₅

Isomers (same molecular formula)

4-[[2-[5-chloro-2-[(4-methoxyphenyl)methoxy]phenyl]acetyl]amino]pyridine-2-carboxylic acid C₂₂H₁₉ClN₂O₅

4-[(1S,3R)-2-(2-chloroacetyl)-3-methoxycarbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoic acid C₂₂H₁₉ClN₂O₅