[2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino] 4-nitrobenzoate

Systemtic Name: [2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino] 4-nitrobenzoate Openeye Name: [[2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acetyl]amino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [[1-oxo-2-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]ethyl]amino] ester IUPAC Name: [[2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]amino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [[2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acetyl]amino] ester Formula: C26H24N4O8 MolecularWeight: 520.49076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC(=O)NOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCC(=O)NOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H24N4O8/c31-23(29-38-25(33)20-11-13-21(14-12-20)30(35)36)16-27-24(32)22(15-18-7-3-1-4-8-18)28-26(34)37-17-19-9-5-2-6-10-19/h1-14,22H,15-17H2,(H,27,32)(H,28,34)(H,29,31)