phenyl 4-octylcyclohexane-1-carboxylate

Systemtic Name: phenyl 4-octylcyclohexane-1-carboxylate Openeye Name: phenyl 4-octylcyclohexanecarboxylate CAS Name: 4-octyl-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-octylcyclohexane-1-carboxylate Traditional Name: 4-octylcyclohexanecarboxylic acid phenyl ester Formula: C21H32O2 MolecularWeight: 316.47758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C21H32O2/c1-2-3-4-5-6-8-11-18-14-16-19(17-15-18)21(22)23-20-12-9-7-10-13-20/h7,9-10,12-13,18-19H,2-6,8,11,14-17H2,1H3