2-(4-heptylcyclohexyl)-3-(4-heptylphenyl)propanenitrile

Systemtic Name: 2-(4-heptylcyclohexyl)-3-(4-heptylphenyl)propanenitrile Openeye Name: 2-(4-heptylcyclohexyl)-3-(4-heptylphenyl)propanenitrile CAS Name: 2-(4-heptylcyclohexyl)-3-(4-heptylphenyl)propanenitrile IUPAC Name: 2-(4-heptylcyclohexyl)-3-(4-heptylphenyl)propanenitrile Traditional Name: 2-(4-heptylcyclohexyl)-3-(4-heptylphenyl)propionitrile Formula: C29H47N MolecularWeight: 409.69018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C(CC2=CC=C(C=C2)CCCCCCC)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C(CC2=CC=C(C=C2)CCCCCCC)C#N

InChI

InChI=1S/C29H47N/c1-3-5-7-9-11-13-25-15-17-27(18-16-25)23-29(24-30)28-21-19-26(20-22-28)14-12-10-8-6-4-2/h15-18,26,28-29H,3-14,19-23H2,1-2H3