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

Systemtic Name: 4-[2-[4-(4-hexylphenyl)cyclohexen-1-yl]ethynyl]benzenecarbonitrile Openeye Name: 4-[2-[4-(4-hexylphenyl)cyclohexen-1-yl]ethynyl]benzonitrile CAS Name: 4-[2-[4-(4-hexylphenyl)-1-cyclohexenyl]ethynyl]benzonitrile IUPAC Name: 4-[2-[4-(4-hexylphenyl)cyclohexen-1-yl]ethynyl]benzonitrile Traditional Name: 4-[2-[4-(4-hexylphenyl)cyclohexen-1-yl]ethynyl]benzonitrile Formula: C27H29N MolecularWeight: 367.52586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2CCC(=CC2)C#CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H29N/c1-2-3-4-5-6-22-13-17-26(18-14-22)27-19-15-24(16-20-27)8-7-23-9-11-25(21-28)12-10-23/h9-15,17-18,27H,2-6,16,19-20H2,1H3