(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: (5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: (5,5-dimethyl-3-oxo-cyclohexen-1-yl) 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid (5,5-dimethyl-3-oxo-1-cyclohexenyl) ester IUPAC Name: (5,5-dimethyl-3-oxocyclohexen-1-yl) 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid (3-keto-5,5-dimethyl-cyclohexen-1-yl) ester Formula: C22H20O4 MolecularWeight: 348.3918

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)OC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)OC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C22H20O4/c1-22(2)11-16(23)10-17(12-22)26-20(24)9-15-13-25-19-8-7-14-5-3-4-6-18(14)21(15)19/h3-8,10,13H,9,11-12H2,1-2H3