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

Systemtic Name: (2S)-2-[(4-nitrophenyl)carbonylamino]-5-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-5-(benzyloxycarbonylamino)-2-[(4-nitrobenzoyl)amino]pentanoic acid CAS Name: (2S)-2-[[(4-nitrophenyl)-oxomethyl]amino]-5-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-2-[(4-nitrobenzoyl)amino]-5-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-5-(benzyloxycarbonylamino)-2-[(4-nitrobenzoyl)amino]valeric acid Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O7/c24-18(15-8-10-16(11-9-15)23(28)29)22-17(19(25)26)7-4-12-21-20(27)30-13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,4,7,12-13H2,(H,21,27)(H,22,24)(H,25,26)/t17-/m0/s1