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

Systemtic Name: 4-heptyl-1-(2-heptylpyrimidin-5-yl)cyclohexane-1-carbonitrile Openeye Name: 4-heptyl-1-(2-heptylpyrimidin-5-yl)cyclohexanecarbonitrile CAS Name: 4-heptyl-1-(2-heptyl-5-pyrimidinyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-heptyl-1-(2-heptylpyrimidin-5-yl)cyclohexane-1-carbonitrile Traditional Name: 4-heptyl-1-(2-heptylpyrimidin-5-yl)cyclohexanecarbonitrile Formula: C25H41N3 MolecularWeight: 383.61314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H41N3/c1-3-5-7-9-11-13-22-15-17-25(21-26,18-16-22)23-19-27-24(28-20-23)14-12-10-8-6-4-2/h19-20,22H,3-18H2,1-2H3