4-[[3-[(3-nitrophenyl)carbonylamino]phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[3-[(3-nitrophenyl)carbonylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[3-[(3-nitrobenzoyl)amino]benzoyl]amino]benzoic acid CAS Name: 4-[[[3-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[3-[(3-nitrobenzoyl)amino]benzoyl]amino]benzoic acid Traditional Name: 4-[[3-[(3-nitrobenzoyl)amino]benzoyl]amino]benzoic acid Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H15N3O6/c25-19(22-16-9-7-13(8-10-16)21(27)28)14-3-1-5-17(11-14)23-20(26)15-4-2-6-18(12-15)24(29)30/h1-12H,(H,22,25)(H,23,26)(H,27,28)