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

Systemtic Name: 4-heptyl-1-(2-hexylpyrimidin-5-yl)cyclohexane-1-carbonitrile Openeye Name: 4-heptyl-1-(2-hexylpyrimidin-5-yl)cyclohexanecarbonitrile CAS Name: 4-heptyl-1-(2-hexyl-5-pyrimidinyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-heptyl-1-(2-hexylpyrimidin-5-yl)cyclohexane-1-carbonitrile Traditional Name: 4-heptyl-1-(2-hexylpyrimidin-5-yl)cyclohexanecarbonitrile Formula: C24H39N3 MolecularWeight: 369.58656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H39N3/c1-3-5-7-9-10-12-21-14-16-24(20-25,17-15-21)22-18-26-23(27-19-22)13-11-8-6-4-2/h18-19,21H,3-17H2,1-2H3