3-[4-(4-heptylcyclohexyl)cyclohexyl]prop-2-ynenitrile

Systemtic Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]prop-2-ynenitrile Openeye Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]prop-2-ynenitrile CAS Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]-2-propynenitrile IUPAC Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]prop-2-ynenitrile Traditional Name: 3-[4-(4-heptylcyclohexyl)cyclohexyl]propiolonitrile Formula: C22H35N MolecularWeight: 313.52

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C#CC#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C#CC#N

InChI

InChI=1S/C22H35N/c1-2-3-4-5-6-8-19-10-14-21(15-11-19)22-16-12-20(13-17-22)9-7-18-23/h19-22H,2-6,8,10-17H2,1H3