(2S)-N-[(2S)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-methyl-2-(4-nitroanilino)-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-(4-nitroanilino)-1-oxopropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-(4-nitroanilino)-1-oxopropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-2-keto-1-methyl-2-(4-nitroanilino)ethyl]pyrrolidine-2-carboxamide Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)[C@@H]2CCCN2

InChI

InChI=1S/C14H18N4O4/c1-9(16-14(20)12-3-2-8-15-12)13(19)17-10-4-6-11(7-5-10)18(21)22/h4-7,9,12,15H,2-3,8H2,1H3,(H,16,20)(H,17,19)/t9-,12-/m0/s1