2-[2-(3,4-dimethoxyphenyl)ethoxy]-7-(hydroxymethyl)-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethoxy]-7-(hydroxymethyl)-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethoxy]-7-(hydroxymethyl)-4-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethoxy]-7-(hydroxymethyl)-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethoxy]-7-(hydroxymethyl)-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-homoveratryloxy-4-isopropyl-7-methylol-cyclohepta-2,4,6-trien-1-one Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)OCCC2=CC(=C(C=C2)OC)OC)CO

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)OCCC2=CC(=C(C=C2)OC)OC)CO

InChI

InChI=1S/C21H26O5/c1-14(2)16-6-7-17(13-22)21(23)20(12-16)26-10-9-15-5-8-18(24-3)19(11-15)25-4/h5-8,11-12,14,22H,9-10,13H2,1-4H3