4-[5-(4-butoxyphenyl)-3-methyl-pyridin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(4-butoxyphenyl)-3-methyl-pyridin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-(4-butoxyphenyl)-3-methyl-2-pyridyl]benzonitrile CAS Name: 4-[5-(4-butoxyphenyl)-3-methyl-2-pyridinyl]benzonitrile IUPAC Name: 4-[5-(4-butoxyphenyl)-3-methylpyridin-2-yl]benzonitrile Traditional Name: 4-[5-(4-butoxyphenyl)-3-methyl-2-pyridyl]benzonitrile Formula: C23H22N2O MolecularWeight: 342.43358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC(=C(N=C2)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC(=C(N=C2)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C23H22N2O/c1-3-4-13-26-22-11-9-19(10-12-22)21-14-17(2)23(25-16-21)20-7-5-18(15-24)6-8-20/h5-12,14,16H,3-4,13H2,1-2H3