4-[1-cyano-4-(4-propylcyclohexyl)cyclohexyl]pentanoic acid

Systemtic Name: 4-[1-cyano-4-(4-propylcyclohexyl)cyclohexyl]pentanoic acid Openeye Name: 4-[1-cyano-4-(4-propylcyclohexyl)cyclohexyl]pentanoic acid CAS Name: 4-[1-cyano-4-(4-propylcyclohexyl)cyclohexyl]pentanoic acid IUPAC Name: 4-[1-cyano-4-(4-propylcyclohexyl)cyclohexyl]pentanoic acid Traditional Name: 4-[1-cyano-4-(4-propylcyclohexyl)cyclohexyl]valeric acid Formula: C21H35NO2 MolecularWeight: 333.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2CCC(CC2)(C#N)C(C)CCC(=O)O

Isomeric SMILES

CCCC1CCC(CC1)C2CCC(CC2)(C#N)C(C)CCC(=O)O

InChI

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