(4-nitrophenyl)methyl 6-[(2-aminophenyl)carbonylamino]-2-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: (4-nitrophenyl)methyl 6-[(2-aminophenyl)carbonylamino]-2-(phenylmethoxycarbonylamino)hexanoate Openeye Name: (4-nitrophenyl)methyl 6-[(2-aminobenzoyl)amino]-2-(benzyloxycarbonylamino)hexanoate CAS Name: 6-[[(2-aminophenyl)-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 6-[(2-aminobenzoyl)amino]-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-(anthraniloylamino)-2-(benzyloxycarbonylamino)hexanoic acid (4-nitrobenzyl) ester Formula: C28H30N4O7 MolecularWeight: 534.5604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)C2=CC=CC=C2N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)C2=CC=CC=C2N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C28H30N4O7/c29-24-11-5-4-10-23(24)26(33)30-17-7-6-12-25(31-28(35)39-19-20-8-2-1-3-9-20)27(34)38-18-21-13-15-22(16-14-21)32(36)37/h1-5,8-11,13-16,25H,6-7,12,17-19,29H2,(H,30,33)(H,31,35)