4-[4-(4-ethylphenyl)phenyl]-1-heptyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-ethylphenyl)phenyl]-1-heptyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-ethylphenyl)phenyl]-1-heptyl-cyclohexanecarbonitrile CAS Name: 4-[4-(4-ethylphenyl)phenyl]-1-heptyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-ethylphenyl)phenyl]-1-heptylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-ethylphenyl)phenyl]-1-heptyl-cyclohexanecarbonitrile Formula: C28H37N MolecularWeight: 387.60008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC)C#N

InChI

InChI=1S/C28H37N/c1-3-5-6-7-8-19-28(22-29)20-17-27(18-21-28)26-15-13-25(14-16-26)24-11-9-23(4-2)10-12-24/h9-16,27H,3-8,17-21H2,1-2H3