(2S)-5-[(4-nitrophenyl)amino]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-[(4-nitrophenyl)amino]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-5-(4-nitroanilino)-5-oxo-pentanoic acid CAS Name: (2S)-5-(4-nitroanilino)-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-5-(4-nitroanilino)-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-keto-5-(4-nitroanilino)valeric acid Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O7/c23-17(20-14-6-8-15(9-7-14)22(27)28)11-10-16(18(24)25)21-19(26)29-12-13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,20,23)(H,21,26)(H,24,25)/t16-/m0/s1