3-[4-(4-heptylphenyl)cyclohexyl]-2-(4-propylcyclohexyl)propanenitrile

Systemtic Name: 3-[4-(4-heptylphenyl)cyclohexyl]-2-(4-propylcyclohexyl)propanenitrile Openeye Name: 3-[4-(4-heptylphenyl)cyclohexyl]-2-(4-propylcyclohexyl)propanenitrile CAS Name: 3-[4-(4-heptylphenyl)cyclohexyl]-2-(4-propylcyclohexyl)propanenitrile IUPAC Name: 3-[4-(4-heptylphenyl)cyclohexyl]-2-(4-propylcyclohexyl)propanenitrile Traditional Name: 3-[4-(4-heptylphenyl)cyclohexyl]-2-(4-propylcyclohexyl)propionitrile Formula: C31H49N MolecularWeight: 435.72746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)CC(C#N)C3CCC(CC3)CCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)CC(C#N)C3CCC(CC3)CCC

InChI

InChI=1S/C31H49N/c1-3-5-6-7-8-10-26-13-17-28(18-14-26)29-21-15-27(16-22-29)23-31(24-32)30-19-11-25(9-4-2)12-20-30/h13-14,17-18,25,27,29-31H,3-12,15-16,19-23H2,1-2H3