methyl (3S)-4-[(2-nitrophenyl)amino]-4-oxidanylidene-3-pyrrolidin-1-yl-butanoate

Systemtic Name: methyl (3S)-4-[(2-nitrophenyl)amino]-4-oxidanylidene-3-pyrrolidin-1-yl-butanoate Openeye Name: methyl (3S)-4-(2-nitroanilino)-4-oxo-3-pyrrolidin-1-yl-butanoate CAS Name: (3S)-4-(2-nitroanilino)-4-oxo-3-(1-pyrrolidinyl)butanoic acid methyl ester IUPAC Name: methyl (3S)-4-(2-nitroanilino)-4-oxo-3-pyrrolidin-1-ylbutanoate Traditional Name: (3S)-4-keto-4-(2-nitroanilino)-3-pyrrolidino-butyric acid methyl ester Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])N2CCCC2

Isomeric SMILES

COC(=O)C[C@@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C15H19N3O5/c1-23-14(19)10-13(17-8-4-5-9-17)15(20)16-11-6-2-3-7-12(11)18(21)22/h2-3,6-7,13H,4-5,8-10H2,1H3,(H,16,20)/t13-/m0/s1