(4-cyano-4-heptyl-cyclohexyl) 4-(4-butylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: (4-cyano-4-heptyl-cyclohexyl) 4-(4-butylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-cyano-4-heptyl-cyclohexyl) 4-(4-butylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-butylcyclohexyl)-1-cyclohexanecarboxylic acid (4-cyano-4-heptylcyclohexyl) ester IUPAC Name: (4-cyano-4-heptylcyclohexyl) 4-(4-butylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-butylcyclohexyl)cyclohexanecarboxylic acid (4-cyano-4-heptyl-cyclohexyl) ester Formula: C31H53NO2 MolecularWeight: 471.75802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCCC)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCCC)C#N

InChI

InChI=1S/C31H53NO2/c1-3-5-7-8-9-21-31(24-32)22-19-29(20-23-31)34-30(33)28-17-15-27(16-18-28)26-13-11-25(12-14-26)10-6-4-2/h25-29H,3-23H2,1-2H3