4-[4-[(1E,3Z)-4-methylhepta-1,3-dienyl]cyclohexyl]benzenecarbonitrile

Systemtic Name: 4-[4-[(1E,3Z)-4-methylhepta-1,3-dienyl]cyclohexyl]benzenecarbonitrile Openeye Name: 4-[4-[(1E,3Z)-4-methylhepta-1,3-dienyl]cyclohexyl]benzonitrile CAS Name: 4-[4-[(1E,3Z)-4-methylhepta-1,3-dienyl]cyclohexyl]benzonitrile IUPAC Name: 4-[4-[(1E,3Z)-4-methylhepta-1,3-dienyl]cyclohexyl]benzonitrile Traditional Name: 4-[4-[(1E,3Z)-4-methylhepta-1,3-dienyl]cyclohexyl]benzonitrile Formula: C21H27N MolecularWeight: 293.44578

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=CC=CC1CCC(CC1)C2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCC/C(=C\C=C\C1CCC(CC1)C2=CC=C(C=C2)C#N)/C

InChI

InChI=1S/C21H27N/c1-3-5-17(2)6-4-7-18-8-12-20(13-9-18)21-14-10-19(16-22)11-15-21/h4,6-7,10-11,14-15,18,20H,3,5,8-9,12-13H2,1-2H3/b7-4+,17-6-