4-[4-(4-heptylcyclohexyl)cyclohexa-1,5-dien-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-heptylcyclohexyl)cyclohexa-1,5-dien-1-yl]benzenecarbonitrile Openeye Name: 4-[4-(4-heptylcyclohexyl)cyclohexa-1,5-dien-1-yl]benzonitrile CAS Name: 4-[4-(4-heptylcyclohexyl)-1-cyclohexa-1,5-dienyl]benzonitrile IUPAC Name: 4-[4-(4-heptylcyclohexyl)cyclohexa-1,5-dien-1-yl]benzonitrile Traditional Name: 4-[4-(4-heptylcyclohexyl)cyclohexa-1,5-dien-1-yl]benzonitrile Formula: C26H35N MolecularWeight: 361.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H35N/c1-2-3-4-5-6-7-21-8-12-23(13-9-21)25-16-18-26(19-17-25)24-14-10-22(20-27)11-15-24/h10-11,14-16,18-19,21,23,25H,2-9,12-13,17H2,1H3