4-[[4-(5-heptylpyrimidin-2-yl)cyclohexyl]methoxy]benzenecarbonitrile

Systemtic Name: 4-[[4-(5-heptylpyrimidin-2-yl)cyclohexyl]methoxy]benzenecarbonitrile Openeye Name: 4-[[4-(5-heptylpyrimidin-2-yl)cyclohexyl]methoxy]benzonitrile CAS Name: 4-[[4-(5-heptyl-2-pyrimidinyl)cyclohexyl]methoxy]benzonitrile IUPAC Name: 4-[[4-(5-heptylpyrimidin-2-yl)cyclohexyl]methoxy]benzonitrile Traditional Name: 4-[[4-(5-heptylpyrimidin-2-yl)cyclohexyl]methoxy]benzonitrile Formula: C25H33N3O MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2CCC(CC2)COC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2CCC(CC2)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H33N3O/c1-2-3-4-5-6-7-22-17-27-25(28-18-22)23-12-8-21(9-13-23)19-29-24-14-10-20(16-26)11-15-24/h10-11,14-15,17-18,21,23H,2-9,12-13,19H2,1H3