[2-[(2S)-butan-2-yl]phenyl] (3S)-1-(2-methoxy-4-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(2S)-butan-2-yl]phenyl] (3S)-1-(2-methoxy-4-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-[(1S)-1-methylpropyl]phenyl] (3S)-1-(2-methoxy-4-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-methoxy-4-nitrophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-[(2S)-butan-2-yl]phenyl] ester IUPAC Name: [2-[(2S)-butan-2-yl]phenyl] (3S)-1-(2-methoxy-4-nitrophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(2-methoxy-4-nitro-phenyl)pyrrolidine-3-carboxylic acid [2-[(1S)-1-methylpropyl]phenyl] ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OC(=O)C2CC(=O)N(C2)C3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OC(=O)[C@H]2CC(=O)N(C2)C3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H24N2O6/c1-4-14(2)17-7-5-6-8-19(17)30-22(26)15-11-21(25)23(13-15)18-10-9-16(24(27)28)12-20(18)29-3/h5-10,12,14-15H,4,11,13H2,1-3H3/t14-,15-/m0/s1