[(1S)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [(1S)-2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [(1S)-2-(3-acetylanilino)-2-oxo-1-phenyl-ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [(1S)-2-(3-acetylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(3-acetylanilino)-2-oxo-1-phenylethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [(1S)-2-(3-acetylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=CN3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC=CN3

InChI

InChI=1S/C21H18N2O4/c1-14(24)16-9-5-10-17(13-16)23-20(25)19(15-7-3-2-4-8-15)27-21(26)18-11-6-12-22-18/h2-13,19,22H,1H3,(H,23,25)/t19-/m0/s1