2-[4-[[2-butyl-6-chloranyl-4-(hydroxymethyl)pyridin-3-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[2-butyl-6-chloranyl-4-(hydroxymethyl)pyridin-3-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[2-butyl-6-chloro-4-(hydroxymethyl)-3-pyridyl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[2-butyl-6-chloro-4-(hydroxymethyl)-3-pyridinyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[2-butyl-6-chloro-4-(hydroxymethyl)pyridin-3-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(2-butyl-6-chloro-4-methylol-3-pyridyl)methyl]phenyl]benzonitrile Formula: C24H23ClN2O MolecularWeight: 390.90522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC(=N1)Cl)CO)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CCCCC1=C(C(=CC(=N1)Cl)CO)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C24H23ClN2O/c1-2-3-8-23-22(20(16-28)14-24(25)27-23)13-17-9-11-18(12-10-17)21-7-5-4-6-19(21)15-26/h4-7,9-12,14,28H,2-3,8,13,16H2,1H3