(3S)-3-azanyl-4-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-[(2S)-2-[(4-nitroanilino)-oxomethyl]-1-pyrrolidinyl]-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-keto-4-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidino]butyric acid Formula: C15H18N4O6 MolecularWeight: 350.32662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC(=O)O)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@H](CC(=O)O)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O6/c16-11(8-13(20)21)15(23)18-7-1-2-12(18)14(22)17-9-3-5-10(6-4-9)19(24)25/h3-6,11-12H,1-2,7-8,16H2,(H,17,22)(H,20,21)/t11-,12-/m0/s1