3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-(3-oxidanylidene-1H-benzo[f]isoindol-2-yl)propanoic acid

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-(3-oxidanylidene-1H-benzo[f]isoindol-2-yl)propanoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-(3-oxo-1H-benzo[f]isoindol-2-yl)propanoic acid CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(3-oxo-1H-benzo[f]isoindol-2-yl)propanoic acid IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(3-oxo-1H-benzo[f]isoindol-2-yl)propanoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-(3-keto-1H-benz[f]isoindol-2-yl)propionic acid Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)O)N2CC3=CC4=CC=CC=C4C=C3C2=O)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)O)N2CC3=CC4=CC=CC=C4C=C3C2=O)OC5CCCC5

InChI

InChI=1S/C27H27NO5/c1-32-24-11-10-19(14-25(24)33-21-8-4-5-9-21)23(15-26(29)30)28-16-20-12-17-6-2-3-7-18(17)13-22(20)27(28)31/h2-3,6-7,10-14,21,23H,4-5,8-9,15-16H2,1H3,(H,29,30)