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

Systemtic Name: 2-[4-(4-ethoxy-9-methoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(4-ethoxy-9-methoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid CAS Name: 2-[4-(4-ethoxy-9-methoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid IUPAC Name: 2-[4-(4-ethoxy-9-methoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid Traditional Name: 2-[4-(4-ethoxy-3-keto-9-methoxy-1H-benz[f]isoindol-2-yl)phenyl]acetic acid Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C3=CC=CC=C31)OC)CN(C2=O)C4=CC=C(C=C4)CC(=O)O

Isomeric SMILES

CCOC1=C2C(=C(C3=CC=CC=C31)OC)CN(C2=O)C4=CC=C(C=C4)CC(=O)O

InChI

InChI=1S/C23H21NO5/c1-3-29-22-17-7-5-4-6-16(17)21(28-2)18-13-24(23(27)20(18)22)15-10-8-14(9-11-15)12-19(25)26/h4-11H,3,12-13H2,1-2H3,(H,25,26)