(4-pentanoyloxyphenyl) 4-(4-butylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: (4-pentanoyloxyphenyl) 4-(4-butylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-pentanoyloxyphenyl) 4-(4-butylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-butylcyclohexyl)-1-cyclohexanecarboxylic acid [4-(1-oxopentoxy)phenyl] ester IUPAC Name: (4-pentanoyloxyphenyl) 4-(4-butylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-butylcyclohexyl)cyclohexanecarboxylic acid (4-valeryloxyphenyl) ester Formula: C28H42O4 MolecularWeight: 442.63068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)OC(=O)CCCC

Isomeric SMILES

CCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)OC(=O)CCCC

InChI

InChI=1S/C28H42O4/c1-3-5-7-21-9-11-22(12-10-21)23-13-15-24(16-14-23)28(30)32-26-19-17-25(18-20-26)31-27(29)8-6-4-2/h17-24H,3-16H2,1-2H3