3-[1,3-bis(oxidanylidene)-5-(phenylcarbonyl)isoindol-2-yl]benzoic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)-5-(phenylcarbonyl)isoindol-2-yl]benzoic acid Openeye Name: 3-(5-benzoyl-1,3-dioxo-isoindolin-2-yl)benzoic acid CAS Name: 3-(5-benzoyl-1,3-dioxo-2-isoindolyl)benzoic acid IUPAC Name: 3-(5-benzoyl-1,3-dioxoisoindol-2-yl)benzoic acid Traditional Name: 3-(5-benzoyl-1,3-diketo-isoindolin-2-yl)benzoic acid Formula: C22H13NO5 MolecularWeight: 371.34232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C22H13NO5/c24-19(13-5-2-1-3-6-13)14-9-10-17-18(12-14)21(26)23(20(17)25)16-8-4-7-15(11-16)22(27)28/h1-12H,(H,27,28)