2-[(3Z)-1-oxidanylidene-3-(phenylmethylidene)isoindol-2-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-1-oxidanylidene-3-(phenylmethylidene)isoindol-2-yl]ethanoic acid Openeye Name: 2-[(1Z)-1-benzylidene-3-oxo-isoindolin-2-yl]acetic acid CAS Name: 2-[(3Z)-1-oxo-3-(phenylmethylene)-2-isoindolyl]acetic acid IUPAC Name: 2-[(1Z)-1-benzylidene-3-oxoisoindol-2-yl]acetic acid Traditional Name: 2-[(1Z)-1-benzal-3-keto-isoindolin-2-yl]acetic acid Formula: C17H13NO3 MolecularWeight: 279.29002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C2C3=CC=CC=C3C(=O)N2CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C\2/C3=CC=CC=C3C(=O)N2CC(=O)O

InChI

InChI=1S/C17H13NO3/c19-16(20)11-18-15(10-12-6-2-1-3-7-12)13-8-4-5-9-14(13)17(18)21/h1-10H,11H2,(H,19,20)/b15-10-