(3S)-N-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(4-methyl-3-nitro-phenyl)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide CAS Name: (3S)-N-(4-methyl-3-nitrophenyl)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(4-methyl-3-nitrophenyl)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-(4-methyl-3-nitro-phenyl)-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)[C@H](C)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4/c1-13-8-9-17(11-18(13)23(26)27)21-20(25)16-10-19(24)22(12-16)14(2)15-6-4-3-5-7-15/h3-9,11,14,16H,10,12H2,1-2H3,(H,21,25)/t14-,16+/m1/s1