[4-(4-cyclohexylcyclohexyl)-1-propyl-cyclohexyl] 4-cyanobenzoate

Systemtic Name: [4-(4-cyclohexylcyclohexyl)-1-propyl-cyclohexyl] 4-cyanobenzoate Openeye Name: [4-(4-cyclohexylcyclohexyl)-1-propyl-cyclohexyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [4-(4-cyclohexylcyclohexyl)-1-propylcyclohexyl] ester IUPAC Name: [4-(4-cyclohexylcyclohexyl)-1-propylcyclohexyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [4-(4-cyclohexylcyclohexyl)-1-propyl-cyclohexyl] ester Formula: C29H41NO2 MolecularWeight: 435.64134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(CC1)C2CCC(CC2)C3CCCCC3)OC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCC1(CCC(CC1)C2CCC(CC2)C3CCCCC3)OC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H41NO2/c1-2-18-29(32-28(31)27-10-8-22(21-30)9-11-27)19-16-26(17-20-29)25-14-12-24(13-15-25)23-6-4-3-5-7-23/h8-11,23-26H,2-7,12-20H2,1H3