propyl 2-[2,4,6-trimethyl-1-(phenylcarbonyl)cyclohexyl]ethanoate

Systemtic Name: propyl 2-[2,4,6-trimethyl-1-(phenylcarbonyl)cyclohexyl]ethanoate Openeye Name: propyl 2-(1-benzoyl-2,4,6-trimethyl-cyclohexyl)acetate CAS Name: 2-(1-benzoyl-2,4,6-trimethylcyclohexyl)acetic acid propyl ester IUPAC Name: propyl 2-(1-benzoyl-2,4,6-trimethylcyclohexyl)acetate Traditional Name: 2-(1-benzoyl-2,4,6-trimethyl-cyclohexyl)acetic acid propyl ester Formula: C21H30O3 MolecularWeight: 330.4611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CC1(C(CC(CC1C)C)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)CC1(C(CC(CC1C)C)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H30O3/c1-5-11-24-19(22)14-21(16(3)12-15(2)13-17(21)4)20(23)18-9-7-6-8-10-18/h6-10,15-17H,5,11-14H2,1-4H3