2-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-1H-isoindole-4-carboxylic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-1H-isoindole-4-carboxylic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-isoindoline-4-carboxylic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-1H-isoindole-4-carboxylic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-1H-isoindole-4-carboxylic acid Traditional Name: 2-homoveratryl-3-keto-isoindoline-4-carboxylic acid Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC3=CC=CC(=C3C2=O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC3=CC=CC(=C3C2=O)C(=O)O)OC

InChI

InChI=1S/C19H19NO5/c1-24-15-7-6-12(10-16(15)25-2)8-9-20-11-13-4-3-5-14(19(22)23)17(13)18(20)21/h3-7,10H,8-9,11H2,1-2H3,(H,22,23)