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

Systemtic Name: 2-(4-heptylcyclohexyl)-3-(4-propylphenyl)propanenitrile Openeye Name: 2-(4-heptylcyclohexyl)-3-(4-propylphenyl)propanenitrile CAS Name: 2-(4-heptylcyclohexyl)-3-(4-propylphenyl)propanenitrile IUPAC Name: 2-(4-heptylcyclohexyl)-3-(4-propylphenyl)propanenitrile Traditional Name: 2-(4-heptylcyclohexyl)-3-(4-propylphenyl)propionitrile Formula: C25H39N MolecularWeight: 353.58386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39N/c1-3-5-6-7-8-10-22-15-17-24(18-16-22)25(20-26)19-23-13-11-21(9-4-2)12-14-23/h11-14,22,24-25H,3-10,15-19H2,1-2H3