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3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile

3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile

Systemtic Name:3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile
Openeye Name:3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)phthalonitrile
CAS Name:3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile
IUPAC Name:3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile
Traditional Name:3-(4-butoxyphenyl)-6-(4-heptylcyclohexyl)phthalonitrile
Formula: C31H40N2O
MolecularWeight: 456.6621
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C31H40N2O/c1-3-5-7-8-9-10-24-11-13-25(14-12-24)28-19-20-29(31(23-33)30(28)22-32)26-15-17-27(18-16-26)34-21-6-4-2/h15-20,24-25H,3-14,21H2,1-2H3


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