(3,5,5-trimethylcyclohexen-1-yl) benzoate

Systemtic Name: (3,5,5-trimethylcyclohexen-1-yl) benzoate Openeye Name: (3,5,5-trimethylcyclohexen-1-yl) benzoate CAS Name: benzoic acid (3,5,5-trimethyl-1-cyclohexenyl) ester IUPAC Name: (3,5,5-trimethylcyclohexen-1-yl) benzoate Traditional Name: benzoic acid (3,5,5-trimethylcyclohexen-1-yl) ester Formula: C16H20O2 MolecularWeight: 244.3288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(=C1)OC(=O)C2=CC=CC=C2)(C)C

Isomeric SMILES

CC1CC(CC(=C1)OC(=O)C2=CC=CC=C2)(C)C

InChI

InChI=1S/C16H20O2/c1-12-9-14(11-16(2,3)10-12)18-15(17)13-7-5-4-6-8-13/h4-9,12H,10-11H2,1-3H3