3-chloranyl-4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]benzenecarbonitrile Openeye Name: 3-chloro-4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]benzonitrile CAS Name: 3-chloro-4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]benzonitrile IUPAC Name: 3-chloro-4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]benzonitrile Traditional Name: 3-chloro-4-[4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]phenyl]benzonitrile Formula: C34H40ClN MolecularWeight: 498.1411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)C4=C(C=C(C=C4)C#N)Cl

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)C4=C(C=C(C=C4)C#N)Cl

InChI

InChI=1S/C34H40ClN/c1-2-3-4-5-6-7-26-10-17-30(18-11-26)31-19-12-27(13-20-31)8-9-28-14-21-32(22-15-28)33-23-16-29(25-36)24-34(33)35/h12-16,19-24,26,30H,2-11,17-18H2,1H3