[4-(4-cyano-4-propyl-cyclohexyl)cyclohexyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [4-(4-cyano-4-propyl-cyclohexyl)cyclohexyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [4-(4-cyano-4-propyl-cyclohexyl)cyclohexyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [4-(4-cyano-4-propylcyclohexyl)cyclohexyl] ester IUPAC Name: [4-(4-cyano-4-propylcyclohexyl)cyclohexyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [4-(4-cyano-4-propyl-cyclohexyl)cyclohexyl] ester Formula: C27H45NO2 MolecularWeight: 415.6517

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OC2CCC(CC2)C3CCC(CC3)(CCC)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OC2CCC(CC2)C3CCC(CC3)(CCC)C#N

InChI

InChI=1S/C27H45NO2/c1-3-5-6-21-7-9-24(10-8-21)26(29)30-25-13-11-22(12-14-25)23-15-18-27(20-28,17-4-2)19-16-23/h21-25H,3-19H2,1-2H3