3,5-bis[(4-nitrophenyl)carbonylamino]benzoic acid

Systemtic Name: 3,5-bis[(4-nitrophenyl)carbonylamino]benzoic acid Openeye Name: 3,5-bis[(4-nitrobenzoyl)amino]benzoic acid CAS Name: 3,5-bis[[(4-nitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3,5-bis[(4-nitrobenzoyl)amino]benzoic acid Traditional Name: 3,5-bis[(4-nitrobenzoyl)amino]benzoic acid Formula: C21H14N4O8 MolecularWeight: 450.35786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N4O8/c26-19(12-1-5-17(6-2-12)24(30)31)22-15-9-14(21(28)29)10-16(11-15)23-20(27)13-3-7-18(8-4-13)25(32)33/h1-11H,(H,22,26)(H,23,27)(H,28,29)