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

Systemtic Name: 2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)-3-methoxy-phenyl]ethanoic acid Openeye Name: 2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)-3-methoxy-phenyl]acetic acid CAS Name: 2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)-3-methoxyphenyl]acetic acid IUPAC Name: 2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)-3-methoxyphenyl]acetic acid Traditional Name: 2-[4-(4,9-diethoxy-3-keto-1H-benz[f]isoindol-2-yl)-3-methoxy-phenyl]acetic acid Formula: C25H25NO6 MolecularWeight: 435.4691

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=C(C=C(C=C4)CC(=O)O)OC

Isomeric SMILES

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=C(C=C(C=C4)CC(=O)O)OC

InChI

InChI=1S/C25H25NO6/c1-4-31-23-16-8-6-7-9-17(16)24(32-5-2)22-18(23)14-26(25(22)29)19-11-10-15(13-21(27)28)12-20(19)30-3/h6-12H,4-5,13-14H2,1-3H3,(H,27,28)