3-[4-(4-butylcyclohexyl)-1-cyano-cyclohexyl]butanoic acid

Systemtic Name: 3-[4-(4-butylcyclohexyl)-1-cyano-cyclohexyl]butanoic acid Openeye Name: 3-[4-(4-butylcyclohexyl)-1-cyano-cyclohexyl]butanoic acid CAS Name: 3-[4-(4-butylcyclohexyl)-1-cyanocyclohexyl]butanoic acid IUPAC Name: 3-[4-(4-butylcyclohexyl)-1-cyanocyclohexyl]butanoic acid Traditional Name: 3-[4-(4-butylcyclohexyl)-1-cyano-cyclohexyl]butyric acid Formula: C21H35NO2 MolecularWeight: 333.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2CCC(CC2)(C#N)C(C)CC(=O)O

Isomeric SMILES

CCCCC1CCC(CC1)C2CCC(CC2)(C#N)C(C)CC(=O)O

InChI

InChI=1S/C21H35NO2/c1-3-4-5-17-6-8-18(9-7-17)19-10-12-21(15-22,13-11-19)16(2)14-20(23)24/h16-19H,3-14H2,1-2H3,(H,23,24)