[(2S)-1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-5-oxidanylidenepyrrolidine-2-carboxylate

Systemtic Name: [(2S)-1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-5-oxidanylidenepyrrolidine-2-carboxylate Openeye Name: [(1S)-2-(4-methoxy-2-nitro-anilino)-1-methyl-2-oxo-ethyl] (2S)-5-oxopyrrolidine-2-carboxylate CAS Name: (2S)-5-oxo-2-pyrrolidinecarboxylic acid [(2S)-1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] (2S)-5-oxopyrrolidine-2-carboxylate Traditional Name: (2S)-5-ketopyrrolidine-2-carboxylic acid [(1S)-2-keto-2-(4-methoxy-2-nitro-anilino)-1-methyl-ethyl] ester Formula: C15H17N3O7 MolecularWeight: 351.31138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])OC(=O)C2CCC(=O)N2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])OC(=O)[C@@H]2CCC(=O)N2

InChI

InChI=1S/C15H17N3O7/c1-8(25-15(21)11-5-6-13(19)16-11)14(20)17-10-4-3-9(24-2)7-12(10)18(22)23/h3-4,7-8,11H,5-6H2,1-2H3,(H,16,19)(H,17,20)/t8-,11-/m0/s1