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3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)benzene-1,2-dicarbonitrile

3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)benzene-1,2-dicarbonitrile

Systemtic Name:3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)benzene-1,2-dicarbonitrile
Openeye Name:3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)phthalonitrile
CAS Name:3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)benzene-1,2-dicarbonitrile
IUPAC Name:3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)benzene-1,2-dicarbonitrile
Traditional Name:3-(4-ethylphenyl)-6-(4-heptoxycyclohexyl)phthalonitrile
Formula: C29H36N2O
MolecularWeight: 428.60894
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CC)C#N)C#N


Isomeric SMILES

CCCCCCCOC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CC)C#N)C#N


InChI

InChI=1S/C29H36N2O/c1-3-5-6-7-8-19-32-25-15-13-24(14-16-25)27-18-17-26(28(20-30)29(27)21-31)23-11-9-22(4-2)10-12-23/h9-12,17-18,24-25H,3-8,13-16,19H2,1-2H3


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