4-hexyl-1-(5-pentylpyrimidin-2-yl)cyclohexane-1-carbonitrile

Systemtic Name: 4-hexyl-1-(5-pentylpyrimidin-2-yl)cyclohexane-1-carbonitrile Openeye Name: 4-hexyl-1-(5-pentylpyrimidin-2-yl)cyclohexanecarbonitrile CAS Name: 4-hexyl-1-(5-pentyl-2-pyrimidinyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-hexyl-1-(5-pentylpyrimidin-2-yl)cyclohexane-1-carbonitrile Traditional Name: 1-(5-amylpyrimidin-2-yl)-4-hexyl-cyclohexanecarbonitrile Formula: C22H35N3 MolecularWeight: 341.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)(C#N)C2=NC=C(C=N2)CCCCC

Isomeric SMILES

CCCCCCC1CCC(CC1)(C#N)C2=NC=C(C=N2)CCCCC

InChI

InChI=1S/C22H35N3/c1-3-5-7-9-10-19-12-14-22(18-23,15-13-19)21-24-16-20(17-25-21)11-8-6-4-2/h16-17,19H,3-15H2,1-2H3