2-[[4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-(4-nitro-1,3-dioxo-isoindolin-2-yl)benzoyl]amino]benzoic acid CAS Name: 2-[[[4-(4-nitro-1,3-dioxo-2-isoindolyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-(4-nitro-1,3-dioxoisoindol-2-yl)benzoyl]amino]benzoic acid Traditional Name: 2-[[4-(1,3-diketo-4-nitro-isoindolin-2-yl)benzoyl]amino]benzoic acid Formula: C22H13N3O7 MolecularWeight: 431.35452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H13N3O7/c26-19(23-16-6-2-1-4-14(16)22(29)30)12-8-10-13(11-9-12)24-20(27)15-5-3-7-17(25(31)32)18(15)21(24)28/h1-11H,(H,23,26)(H,29,30)