1-(2-methylbutyl)-4-[4-(5-pent-4-enylpyridin-2-yl)phenyl]cyclohexane-1-carbonitrile

Systemtic Name: 1-(2-methylbutyl)-4-[4-(5-pent-4-enylpyridin-2-yl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-(2-methylbutyl)-4-[4-(5-pent-4-enyl-2-pyridyl)phenyl]cyclohexanecarbonitrile CAS Name: 1-(2-methylbutyl)-4-[4-(5-pent-4-enyl-2-pyridinyl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-(2-methylbutyl)-4-[4-(5-pent-4-enylpyridin-2-yl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 1-(2-methylbutyl)-4-[4-(5-pent-4-enyl-2-pyridyl)phenyl]cyclohexanecarbonitrile Formula: C28H36N2 MolecularWeight: 400.59884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1(CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=C3)CCCC=C)C#N

Isomeric SMILES

CCC(C)CC1(CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=C3)CCCC=C)C#N

InChI

InChI=1S/C28H36N2/c1-4-6-7-8-23-9-14-27(30-20-23)26-12-10-24(11-13-26)25-15-17-28(21-29,18-16-25)19-22(3)5-2/h4,9-14,20,22,25H,1,5-8,15-19H2,2-3H3