[4-pentyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]cyclohexyl] 4-propylcyclohexane-1-carboxylate

Systemtic Name: [4-pentyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]cyclohexyl] 4-propylcyclohexane-1-carboxylate Openeye Name: [4-pentyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]cyclohexyl] 4-propylcyclohexanecarboxylate CAS Name: 4-propyl-1-cyclohexanecarboxylic acid [4-pentyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]cyclohexyl] ester IUPAC Name: [4-pentyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]cyclohexyl] 4-propylcyclohexane-1-carboxylate Traditional Name: 4-propylcyclohexanecarboxylic acid [4-amyl-1-[2-[1-amyl-4-(4-amylcyclohexyl)cyclohexyl]ethynyl]cyclohexyl] ester Formula: C45H78O2 MolecularWeight: 651.09962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCC(CC2)(CCCCC)C#CC3(CCC(CC3)CCCCC)OC(=O)C4CCC(CC4)CCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCC(CC2)(CCCCC)C#CC3(CCC(CC3)CCCCC)OC(=O)C4CCC(CC4)CCC

InChI

InChI=1S/C45H78O2/c1-5-9-12-16-38-18-22-40(23-19-38)41-28-31-44(32-29-41,30-14-11-7-3)35-36-45(33-26-39(27-34-45)17-13-10-6-2)47-43(46)42-24-20-37(15-8-4)21-25-42/h37-42H,5-34H2,1-4H3