[cyano-(3-cyclohexyloxycyclohexyl)methyl] 2-(4-chloranylcyclohexyl)-3-methyl-butanoate

Systemtic Name: [cyano-(3-cyclohexyloxycyclohexyl)methyl] 2-(4-chloranylcyclohexyl)-3-methyl-butanoate Openeye Name: [cyano-[3-(cyclohexoxy)cyclohexyl]methyl] 2-(4-chlorocyclohexyl)-3-methyl-butanoate CAS Name: 2-(4-chlorocyclohexyl)-3-methylbutanoic acid [cyano-(3-cyclohexyloxycyclohexyl)methyl] ester IUPAC Name: [cyano-(3-cyclohexyloxycyclohexyl)methyl] 2-(4-chlorocyclohexyl)-3-methylbutanoate Traditional Name: 2-(4-chlorocyclohexyl)-3-methyl-butyric acid [cyano-[3-(cyclohexoxy)cyclohexyl]methyl] ester Formula: C25H40ClNO3 MolecularWeight: 438.043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1CCC(CC1)Cl)C(=O)OC(C#N)C2CCCC(C2)OC3CCCCC3

Isomeric SMILES

CC(C)C(C1CCC(CC1)Cl)C(=O)OC(C#N)C2CCCC(C2)OC3CCCCC3

InChI

InChI=1S/C25H40ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h17-24H,3-15H2,1-2H3