[5,5-dimethyl-3-oxidanylidene-2-(2,4,6-trimethylphenyl)cyclohexen-1-yl] cyclopropanecarboxylate

Systemtic Name: [5,5-dimethyl-3-oxidanylidene-2-(2,4,6-trimethylphenyl)cyclohexen-1-yl] cyclopropanecarboxylate Openeye Name: [5,5-dimethyl-3-oxo-2-(2,4,6-trimethylphenyl)cyclohexen-1-yl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [5,5-dimethyl-3-oxo-2-(2,4,6-trimethylphenyl)-1-cyclohexenyl] ester IUPAC Name: [5,5-dimethyl-3-oxo-2-(2,4,6-trimethylphenyl)cyclohexen-1-yl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid (3-keto-2-mesityl-5,5-dimethyl-cyclohexen-1-yl) ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C(CC(CC2=O)(C)C)OC(=O)C3CC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C(CC(CC2=O)(C)C)OC(=O)C3CC3)C

InChI

InChI=1S/C21H26O3/c1-12-8-13(2)18(14(3)9-12)19-16(22)10-21(4,5)11-17(19)24-20(23)15-6-7-15/h8-9,15H,6-7,10-11H2,1-5H3