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

Systemtic Name: 2-[4-(4-methoxy-3-oxidanylidene-9-propoxy-1H-benzo[f]isoindol-2-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(4-methoxy-3-oxo-9-propoxy-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid CAS Name: 2-[4-(4-methoxy-3-oxo-9-propoxy-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid IUPAC Name: 2-[4-(4-methoxy-3-oxo-9-propoxy-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid Traditional Name: 2-[4-(3-keto-4-methoxy-9-propoxy-1H-benz[f]isoindol-2-yl)phenyl]acetic acid Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OC)C4=CC=C(C=C4)CC(=O)O

Isomeric SMILES

CCCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OC)C4=CC=C(C=C4)CC(=O)O

InChI

InChI=1S/C24H23NO5/c1-3-12-30-22-17-6-4-5-7-18(17)23(29-2)21-19(22)14-25(24(21)28)16-10-8-15(9-11-16)13-20(26)27/h4-11H,3,12-14H2,1-2H3,(H,26,27)