Netarsudil Impurity 3

cas: 2098444-97-2 — see every product listed under this CAS number, including other names

Netarsudil Impurity 3 (CAS 2098444-97-2) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-N052803
cas2098444-97-2
sizeon request
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Structural formula: {0} (CAS {1})

(2R)-2-[4-[(2,4-dimethylbenzoyl)oxymethyl]phenyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid (CAS 2098444-97-2) is a chemical compound with the molecular formula C24H29NO6 and a molecular weight of 427.5 g/mol. IUPAC name: (2R)-2-[4-[(2,4-dimethylbenzoyl)oxymethyl]phenyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid. InChIKey: GZKGVCBKFIAZRP-FQEVSTJZSA-N.

Identity
Molecular formulaC24H29NO6
Molecular weight427.5 g/mol
IUPAC name(2R)-2-[4-[(2,4-dimethylbenzoyl)oxymethyl]phenyl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChIKeyGZKGVCBKFIAZRP-FQEVSTJZSA-N
SMILESCC1=CC(=C(C=C1)C(=O)OCC2=CC=C(C=C2)[C@H](CNC(=O)OC(C)(C)C)C(=O)O)C

Computed by PubChem (NCBI)

Isomers (same molecular formula)
1-O-benzyl 5-O-tert-butyl (2S)-2-(phenylmethoxycarbonylamino)pentanedioate C24H29NO6
(2S)-3-(4-hydroxyphenyl)-2-[[(2Z,4E)-5-[(1R)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoyl]amino]propanoic acid C24H29NO6

Also listed as

Netarsudil Impurity 4 Chemat Brand CAS 2098444-97-2