[(1S,2R,3R)-2,3-dimethyl-3-(4-methylphenyl)cyclopentyl] benzoate

Systemtic Name: [(1S,2R,3R)-2,3-dimethyl-3-(4-methylphenyl)cyclopentyl] benzoate Openeye Name: [(1S,2R,3R)-2,3-dimethyl-3-(p-tolyl)cyclopentyl] benzoate CAS Name: benzoic acid [(1S,2R,3R)-2,3-dimethyl-3-(4-methylphenyl)cyclopentyl] ester IUPAC Name: [(1S,2R,3R)-2,3-dimethyl-3-(4-methylphenyl)cyclopentyl] benzoate Traditional Name: benzoic acid [(1S,2R,3R)-2,3-dimethyl-3-(p-tolyl)cyclopentyl] ester Formula: C21H24O2 MolecularWeight: 308.41406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC1(C)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@H](CC[C@@]1(C)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24O2/c1-15-9-11-18(12-10-15)21(3)14-13-19(16(21)2)23-20(22)17-7-5-4-6-8-17/h4-12,16,19H,13-14H2,1-3H3/t16-,19-,21+/m0/s1