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3-(4-hexylcyclohexyl)-6-(4-methylphenyl)benzene-1,2-dicarbonitrile

3-(4-hexylcyclohexyl)-6-(4-methylphenyl)benzene-1,2-dicarbonitrile

Systemtic Name:3-(4-hexylcyclohexyl)-6-(4-methylphenyl)benzene-1,2-dicarbonitrile
Openeye Name:3-(4-hexylcyclohexyl)-6-(p-tolyl)phthalonitrile
CAS Name:3-(4-hexylcyclohexyl)-6-(4-methylphenyl)benzene-1,2-dicarbonitrile
IUPAC Name:3-(4-hexylcyclohexyl)-6-(4-methylphenyl)benzene-1,2-dicarbonitrile
Traditional Name:3-(4-hexylcyclohexyl)-6-(p-tolyl)phthalonitrile
Formula: C27H32N2
MolecularWeight: 384.55638
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C)C#N)C#N


Isomeric SMILES

CCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C)C#N)C#N


InChI

InChI=1S/C27H32N2/c1-3-4-5-6-7-21-10-14-23(15-11-21)25-17-16-24(26(18-28)27(25)19-29)22-12-8-20(2)9-13-22/h8-9,12-13,16-17,21,23H,3-7,10-11,14-15H2,1-2H3


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