1-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethanoyl-4H-pyridine-4-carbonitrile

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethanoyl-4H-pyridine-4-carbonitrile Openeye Name: 3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4H-pyridine-4-carbonitrile CAS Name: 3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4H-pyridine-4-carbonitrile IUPAC Name: 3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4H-pyridine-4-carbonitrile Traditional Name: 3-acetyl-1-homoveratryl-4H-pyridine-4-carbonitrile Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C=CC1C#N)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)C1=CN(C=CC1C#N)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H20N2O3/c1-13(21)16-12-20(9-7-15(16)11-19)8-6-14-4-5-17(22-2)18(10-14)23-3/h4-5,7,9-10,12,15H,6,8H2,1-3H3