5-[[3-carboxylato-4-[(4-nitrophenyl)carbonylamino]phenyl]methyl]-2-[(4-nitrophenyl)carbonylamino]benzoate

Systemtic Name: 5-[[3-carboxylato-4-[(4-nitrophenyl)carbonylamino]phenyl]methyl]-2-[(4-nitrophenyl)carbonylamino]benzoate Openeye Name: 5-[[3-carboxylato-4-[(4-nitrobenzoyl)amino]phenyl]methyl]-2-[(4-nitrobenzoyl)amino]benzoate CAS Name: 5-[[3-carboxylato-4-[[(4-nitrophenyl)-oxomethyl]amino]phenyl]methyl]-2-[[(4-nitrophenyl)-oxomethyl]amino]benzoate IUPAC Name: 5-[[3-carboxylato-4-[(4-nitrobenzoyl)amino]phenyl]methyl]-2-[(4-nitrobenzoyl)amino]benzoate Traditional Name: 5-[3-carboxylato-4-[(4-nitrobenzoyl)amino]benzyl]-2-[(4-nitrobenzoyl)amino]benzoate Formula: C29H18N4O10-2 MolecularWeight: 582.47402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)[O-])C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)[O-])C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C29H20N4O10/c34-26(18-3-7-20(8-4-18)32(40)41)30-24-11-1-16(14-22(24)28(36)37)13-17-2-12-25(23(15-17)29(38)39)31-27(35)19-5-9-21(10-6-19)33(42)43/h1-12,14-15H,13H2,(H,30,34)(H,31,35)(H,36,37)(H,38,39)/p-2