3-[[2-[(3-nitrophenyl)carbonylamino]phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[2-[(3-nitrophenyl)carbonylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[2-[(3-nitrobenzoyl)amino]benzoyl]amino]benzoic acid CAS Name: 3-[[[2-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-[(3-nitrobenzoyl)amino]benzoyl]amino]benzoic acid Traditional Name: 3-[[2-[(3-nitrobenzoyl)amino]benzoyl]amino]benzoic acid Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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