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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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