2-[4-(4,9-dimethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4,9-dimethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(4,9-dimethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid CAS Name: 2-[4-(4,9-dimethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid IUPAC Name: 2-[4-(4,9-dimethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid Traditional Name: 2-[4-(3-keto-4,9-dimethoxy-1H-benz[f]isoindol-2-yl)phenyl]acetic acid Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OC)C4=CC=C(C=C4)CC(=O)O

Isomeric SMILES

COC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OC)C4=CC=C(C=C4)CC(=O)O

InChI

InChI=1S/C22H19NO5/c1-27-20-15-5-3-4-6-16(15)21(28-2)19-17(20)12-23(22(19)26)14-9-7-13(8-10-14)11-18(24)25/h3-10H,11-12H2,1-2H3,(H,24,25)