ethyl 4-[4-(4-butylcyclohexyl)cyclohexyl]-1-methyl-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[4-(4-butylcyclohexyl)cyclohexyl]-1-methyl-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: ethyl 4-[4-(4-butylcyclohexyl)cyclohexyl]-1-methyl-2-oxo-cyclohexanecarboxylate CAS Name: 4-[4-(4-butylcyclohexyl)cyclohexyl]-1-methyl-2-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-butylcyclohexyl)cyclohexyl]-1-methyl-2-oxocyclohexane-1-carboxylate Traditional Name: 4-[4-(4-butylcyclohexyl)cyclohexyl]-2-keto-1-methyl-cyclohexanecarboxylic acid ethyl ester Formula: C26H44O3 MolecularWeight: 404.62576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2CCC(CC2)C3CCC(C(=O)C3)(C)C(=O)OCC

Isomeric SMILES

CCCCC1CCC(CC1)C2CCC(CC2)C3CCC(C(=O)C3)(C)C(=O)OCC

InChI

InChI=1S/C26H44O3/c1-4-6-7-19-8-10-20(11-9-19)21-12-14-22(15-13-21)23-16-17-26(3,24(27)18-23)25(28)29-5-2/h19-23H,4-18H2,1-3H3