5-[1-cyano-4-(4-heptylcyclohexyl)cyclohexyl]hexanoic acid

Systemtic Name: 5-[1-cyano-4-(4-heptylcyclohexyl)cyclohexyl]hexanoic acid Openeye Name: 5-[1-cyano-4-(4-heptylcyclohexyl)cyclohexyl]hexanoic acid CAS Name: 5-[1-cyano-4-(4-heptylcyclohexyl)cyclohexyl]hexanoic acid IUPAC Name: 5-[1-cyano-4-(4-heptylcyclohexyl)cyclohexyl]hexanoic acid Traditional Name: 5-[1-cyano-4-(4-heptylcyclohexyl)cyclohexyl]hexanoic acid Formula: C26H45NO2 MolecularWeight: 403.641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)(C#N)C(C)CCCC(=O)O

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)(C#N)C(C)CCCC(=O)O

InChI

InChI=1S/C26H45NO2/c1-3-4-5-6-7-10-22-12-14-23(15-13-22)24-16-18-26(20-27,19-17-24)21(2)9-8-11-25(28)29/h21-24H,3-19H2,1-2H3,(H,28,29)