ethyl 4-(1-butyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-(1-butyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carboxylate Openeye Name: ethyl 4-(1-butyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarboxylate CAS Name: 4-(1-butyl-4-bicyclo[2.2.2]octanyl)-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-butyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carboxylate Traditional Name: 4-(1-butyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarboxylic acid ethyl ester Formula: C21H36O2 MolecularWeight: 320.50934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CCC(CC1)(CC2)C3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCCCC12CCC(CC1)(CC2)C3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C21H36O2/c1-3-5-10-20-11-14-21(15-12-20,16-13-20)18-8-6-17(7-9-18)19(22)23-4-2/h17-18H,3-16H2,1-2H3