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

Systemtic Name: 1-heptyl-4-[4-(4-propylphenyl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-heptyl-4-[4-(4-propylphenyl)phenyl]cyclohexanecarbonitrile CAS Name: 1-heptyl-4-[4-(4-propylphenyl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-heptyl-4-[4-(4-propylphenyl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 1-heptyl-4-[4-(4-propylphenyl)phenyl]cyclohexanecarbonitrile Formula: C29H39N MolecularWeight: 401.62666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H39N/c1-3-5-6-7-8-20-29(23-30)21-18-28(19-22-29)27-16-14-26(15-17-27)25-12-10-24(9-4-2)11-13-25/h10-17,28H,3-9,18-22H2,1-2H3