(2S)-2-(2,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylamino)ethanenitrile

Systemtic Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylamino)ethanenitrile Openeye Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(4-pyridylmethylamino)acetonitrile CAS Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylamino)acetonitrile IUPAC Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylamino)acetonitrile Traditional Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(4-pyridylmethylamino)acetonitrile Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(C#N)NCC2=CC=NC=C2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@@H](C#N)NCC2=CC=NC=C2)OC

InChI

InChI=1S/C16H17N3O2/c1-20-13-3-4-14(16(9-13)21-2)15(10-17)19-11-12-5-7-18-8-6-12/h3-9,15,19H,11H2,1-2H3/t15-/m1/s1