4-(2-methylbutyl)-1-[2-[4-(4-octylphenyl)cyclohexyl]ethyl]cyclohexane-1-carbonitrile

Systemtic Name: 4-(2-methylbutyl)-1-[2-[4-(4-octylphenyl)cyclohexyl]ethyl]cyclohexane-1-carbonitrile Openeye Name: 4-(2-methylbutyl)-1-[2-[4-(4-octylphenyl)cyclohexyl]ethyl]cyclohexanecarbonitrile CAS Name: 4-(2-methylbutyl)-1-[2-[4-(4-octylphenyl)cyclohexyl]ethyl]-1-cyclohexanecarbonitrile IUPAC Name: 4-(2-methylbutyl)-1-[2-[4-(4-octylphenyl)cyclohexyl]ethyl]cyclohexane-1-carbonitrile Traditional Name: 4-(2-methylbutyl)-1-[2-[4-(4-octylphenyl)cyclohexyl]ethyl]cyclohexanecarbonitrile Formula: C34H55N MolecularWeight: 477.8072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2CCC(CC2)CCC3(CCC(CC3)CC(C)CC)C#N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2CCC(CC2)CCC3(CCC(CC3)CC(C)CC)C#N

InChI

InChI=1S/C34H55N/c1-4-6-7-8-9-10-11-29-12-16-32(17-13-29)33-18-14-30(15-19-33)20-23-34(27-35)24-21-31(22-25-34)26-28(3)5-2/h12-13,16-17,28,30-31,33H,4-11,14-15,18-26H2,1-3H3