ethyl 5-[(2S)-2-[(3-acetamidophenyl)amino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(2S)-2-[(3-acetamidophenyl)amino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(2S)-2-(3-acetamidoanilino)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-(3-acetamidoanilino)-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2S)-2-(3-acetamidoanilino)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-(3-acetamidoanilino)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)NC2=CC=CC(=C2)NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)NC2=CC=CC(=C2)NC(=O)C)C

InChI

InChI=1S/C20H25N3O4/c1-6-27-20(26)17-11(2)18(22-12(17)3)19(25)13(4)21-15-8-7-9-16(10-15)23-14(5)24/h7-10,13,21-22H,6H2,1-5H3,(H,23,24)/t13-/m0/s1