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

Systemtic Name: 4-[4-[2-[4-(4-butylcyclohexyl)phenyl]ethyl]phenyl]-3-chloranyl-benzenecarbonitrile Openeye Name: 4-[4-[2-[4-(4-butylcyclohexyl)phenyl]ethyl]phenyl]-3-chloro-benzonitrile CAS Name: 4-[4-[2-[4-(4-butylcyclohexyl)phenyl]ethyl]phenyl]-3-chlorobenzonitrile IUPAC Name: 4-[4-[2-[4-(4-butylcyclohexyl)phenyl]ethyl]phenyl]-3-chlorobenzonitrile Traditional Name: 4-[4-[2-[4-(4-butylcyclohexyl)phenyl]ethyl]phenyl]-3-chloro-benzonitrile Formula: C31H34ClN MolecularWeight: 456.06136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)C4=C(C=C(C=C4)C#N)Cl

Isomeric SMILES

CCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)C4=C(C=C(C=C4)C#N)Cl

InChI

InChI=1S/C31H34ClN/c1-2-3-4-23-7-14-27(15-8-23)28-16-9-24(10-17-28)5-6-25-11-18-29(19-12-25)30-20-13-26(22-33)21-31(30)32/h9-13,16-21,23,27H,2-8,14-15H2,1H3