4-[4-[2-[4-(4-propylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-[4-(4-propylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-[4-(4-propylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzonitrile CAS Name: 4-[4-[2-[4-(4-propylcyclohexyl)-1-cyclohexenyl]ethynyl]phenyl]benzonitrile IUPAC Name: 4-[4-[2-[4-(4-propylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzonitrile Traditional Name: 4-[4-[2-[4-(4-propylcyclohexyl)cyclohexen-1-yl]ethynyl]phenyl]benzonitrile Formula: C30H33N MolecularWeight: 407.58972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCC1CCC(CC1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C30H33N/c1-2-3-23-6-14-27(15-7-23)28-16-8-24(9-17-28)4-5-25-10-18-29(19-11-25)30-20-12-26(22-31)13-21-30/h8,10-13,18-21,23,27-28H,2-3,6-7,9,14-17H2,1H3