(5,5-dimethyl-4-oxidanylidene-cyclohex-2-en-1-yl) benzoate

Systemtic Name: (5,5-dimethyl-4-oxidanylidene-cyclohex-2-en-1-yl) benzoate Openeye Name: (5,5-dimethyl-4-oxo-cyclohex-2-en-1-yl) benzoate CAS Name: benzoic acid (5,5-dimethyl-4-oxo-1-cyclohex-2-enyl) ester IUPAC Name: (5,5-dimethyl-4-oxocyclohex-2-en-1-yl) benzoate Traditional Name: benzoic acid (4-keto-5,5-dimethyl-cyclohex-2-en-1-yl) ester Formula: C15H16O3 MolecularWeight: 244.28574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C=CC1=O)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(C=CC1=O)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C15H16O3/c1-15(2)10-12(8-9-13(15)16)18-14(17)11-6-4-3-5-7-11/h3-9,12H,10H2,1-2H3