(4S)-4-azanyl-5-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-amino-5-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[(2S)-2-[(4-nitroanilino)-oxomethyl]-1-pyrrolidinyl]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidin-1-yl]-5-oxopentanoic acid Traditional Name: (4S)-4-amino-5-keto-5-[(2S)-2-[(4-nitrophenyl)carbamoyl]pyrrolidino]valeric acid Formula: C16H20N4O6 MolecularWeight: 364.3532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O6/c17-12(7-8-14(21)22)16(24)19-9-1-2-13(19)15(23)18-10-3-5-11(6-4-10)20(25)26/h3-6,12-13H,1-2,7-9,17H2,(H,18,23)(H,21,22)/t12-,13-/m0/s1