5-[2-[4-(4-ethylphenyl)cyclohexyl]ethynyl]-2-propyl-benzenecarbonitrile

Systemtic Name: 5-[2-[4-(4-ethylphenyl)cyclohexyl]ethynyl]-2-propyl-benzenecarbonitrile Openeye Name: 5-[2-[4-(4-ethylphenyl)cyclohexyl]ethynyl]-2-propyl-benzonitrile CAS Name: 5-[2-[4-(4-ethylphenyl)cyclohexyl]ethynyl]-2-propylbenzonitrile IUPAC Name: 5-[2-[4-(4-ethylphenyl)cyclohexyl]ethynyl]-2-propylbenzonitrile Traditional Name: 5-[2-[4-(4-ethylphenyl)cyclohexyl]ethynyl]-2-propyl-benzonitrile Formula: C26H29N MolecularWeight: 355.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CC)C#N

Isomeric SMILES

CCCC1=C(C=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CC)C#N

InChI

InChI=1S/C26H29N/c1-3-5-23-17-12-22(18-26(23)19-27)7-6-21-10-15-25(16-11-21)24-13-8-20(4-2)9-14-24/h8-9,12-14,17-18,21,25H,3-5,10-11,15-16H2,1-2H3