1-nonyl-4-(1-octyl-4-phenyl-cyclohexa-2,5-dien-1-yl)cyclohexane-1-carbonitrile

Systemtic Name: 1-nonyl-4-(1-octyl-4-phenyl-cyclohexa-2,5-dien-1-yl)cyclohexane-1-carbonitrile Openeye Name: 1-nonyl-4-(1-octyl-4-phenyl-cyclohexa-2,5-dien-1-yl)cyclohexanecarbonitrile CAS Name: 1-nonyl-4-(1-octyl-4-phenyl-1-cyclohexa-2,5-dienyl)-1-cyclohexanecarbonitrile IUPAC Name: 1-nonyl-4-(1-octyl-4-phenylcyclohexa-2,5-dien-1-yl)cyclohexane-1-carbonitrile Traditional Name: 1-nonyl-4-(1-octyl-4-phenyl-cyclohexa-2,5-dien-1-yl)cyclohexanecarbonitrile Formula: C36H55N MolecularWeight: 501.8286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(CCC(CC1)C2(C=CC(C=C2)C3=CC=CC=C3)CCCCCCCC)C#N

Isomeric SMILES

CCCCCCCCCC1(CCC(CC1)C2(C=CC(C=C2)C3=CC=CC=C3)CCCCCCCC)C#N

InChI

InChI=1S/C36H55N/c1-3-5-7-9-11-12-17-25-35(31-37)27-23-34(24-28-35)36(26-18-13-10-8-6-4-2)29-21-33(22-30-36)32-19-15-14-16-20-32/h14-16,19-22,29-30,33-34H,3-13,17-18,23-28H2,1-2H3