3-[4-(4-heptylcyclohexyl)cyclohexyl]propanoate

Systemtic Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]propanoate Openeye Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]propanoate CAS Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]propanoate IUPAC Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]propanoate Traditional Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]propionate Formula: C22H39O2- MolecularWeight: 335.54386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)CCC(=O)[O-]

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)CCC(=O)[O-]

InChI

InChI=1S/C22H40O2/c1-2-3-4-5-6-7-18-8-13-20(14-9-18)21-15-10-19(11-16-21)12-17-22(23)24/h18-21H,2-17H2,1H3,(H,23,24)/p-1