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

Systemtic Name: 4-heptyl-1-(2-pentylpyrimidin-5-yl)cyclohexane-1-carbonitrile Openeye Name: 4-heptyl-1-(2-pentylpyrimidin-5-yl)cyclohexanecarbonitrile CAS Name: 4-heptyl-1-(2-pentyl-5-pyrimidinyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-heptyl-1-(2-pentylpyrimidin-5-yl)cyclohexane-1-carbonitrile Traditional Name: 1-(2-amylpyrimidin-5-yl)-4-heptyl-cyclohexanecarbonitrile Formula: C23H37N3 MolecularWeight: 355.55998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)(C#N)C2=CN=C(N=C2)CCCCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)(C#N)C2=CN=C(N=C2)CCCCC

InChI

InChI=1S/C23H37N3/c1-3-5-7-8-10-11-20-13-15-23(19-24,16-14-20)21-17-25-22(26-18-21)12-9-6-4-2/h17-18,20H,3-16H2,1-2H3