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

Systemtic Name: 3-(4-ethylphenyl)-6-(4-propoxycyclohexyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-ethylphenyl)-6-(4-propoxycyclohexyl)phthalonitrile CAS Name: 3-(4-ethylphenyl)-6-(4-propoxycyclohexyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-ethylphenyl)-6-(4-propoxycyclohexyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(4-ethylphenyl)-6-(4-propoxycyclohexyl)phthalonitrile Formula: C25H28N2O MolecularWeight: 372.50262

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CC)C#N)C#N

Isomeric SMILES

CCCOC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CC)C#N)C#N

InChI

InChI=1S/C25H28N2O/c1-3-15-28-21-11-9-20(10-12-21)23-14-13-22(24(16-26)25(23)17-27)19-7-5-18(4-2)6-8-19/h5-8,13-14,20-21H,3-4,9-12,15H2,1-2H3