(4-butylcyclohexyl) 4-(4-butylcyclohexen-1-yl)benzoate

Systemtic Name: (4-butylcyclohexyl) 4-(4-butylcyclohexen-1-yl)benzoate Openeye Name: (4-butylcyclohexyl) 4-(4-butylcyclohexen-1-yl)benzoate CAS Name: 4-(4-butyl-1-cyclohexenyl)benzoic acid (4-butylcyclohexyl) ester IUPAC Name: (4-butylcyclohexyl) 4-(4-butylcyclohexen-1-yl)benzoate Traditional Name: 4-(4-butylcyclohexen-1-yl)benzoic acid (4-butylcyclohexyl) ester Formula: C27H40O2 MolecularWeight: 396.6053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=CCC(CC3)CCCC

Isomeric SMILES

CCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=CCC(CC3)CCCC

InChI

InChI=1S/C27H40O2/c1-3-5-7-21-9-13-23(14-10-21)24-15-17-25(18-16-24)27(28)29-26-19-11-22(12-20-26)8-6-4-2/h13,15-18,21-22,26H,3-12,14,19-20H2,1-2H3