(2S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-pyridin-2-yl-ethanenitrile

Systemtic Name: (2S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-pyridin-2-yl-ethanenitrile Openeye Name: (2S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-(2-pyridyl)acetonitrile CAS Name: (2S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-(2-pyridinyl)acetonitrile IUPAC Name: (2S)-2-[(3,4-dimethoxyphenyl)methylamino]-2-pyridin-2-ylacetonitrile Traditional Name: (2S)-2-(2-pyridyl)-2-(veratrylamino)acetonitrile Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(C#N)C2=CC=CC=N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN[C@H](C#N)C2=CC=CC=N2)OC

InChI

InChI=1S/C16H17N3O2/c1-20-15-7-6-12(9-16(15)21-2)11-19-14(10-17)13-5-3-4-8-18-13/h3-9,14,19H,11H2,1-2H3/t14-/m1/s1