(4-nitrophenyl) 6-azanyl-2-[bis(phenylmethoxycarbonyl)amino]hexanoate

Systemtic Name: (4-nitrophenyl) 6-azanyl-2-[bis(phenylmethoxycarbonyl)amino]hexanoate Openeye Name: (4-nitrophenyl) 6-amino-2-[bis(benzyloxycarbonyl)amino]hexanoate CAS Name: 6-amino-2-[bis(phenylmethoxycarbonyl)amino]hexanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 6-amino-2-[bis(phenylmethoxycarbonyl)amino]hexanoate Traditional Name: 6-amino-2-(dicarbobenzoxyamino)hexanoic acid (4-nitrophenyl) ester Formula: C28H29N3O8 MolecularWeight: 535.54516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(C(CCCCN)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(C(CCCCN)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H29N3O8/c29-18-8-7-13-25(26(32)39-24-16-14-23(15-17-24)31(35)36)30(27(33)37-19-21-9-3-1-4-10-21)28(34)38-20-22-11-5-2-6-12-22/h1-6,9-12,14-17,25H,7-8,13,18-20,29H2