(2S)-2-(3,4-dimethoxyphenyl)-2-pyrazin-2-yl-ethanenitrile

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-2-pyrazin-2-yl-ethanenitrile Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-2-pyrazin-2-yl-acetonitrile CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(2-pyrazinyl)acetonitrile IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-2-pyrazin-2-ylacetonitrile Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-2-pyrazin-2-yl-acetonitrile Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)C2=NC=CN=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O2/c1-18-13-4-3-10(7-14(13)19-2)11(8-15)12-9-16-5-6-17-12/h3-7,9,11H,1-2H3/t11-/m0/s1