(2S)-2-(2,4-dimethoxyphenyl)-2-(prop-2-enylamino)ethanenitrile

Systemtic Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(prop-2-enylamino)ethanenitrile Openeye Name: (2S)-2-(allylamino)-2-(2,4-dimethoxyphenyl)acetonitrile CAS Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(prop-2-enylamino)acetonitrile IUPAC Name: (2S)-2-(2,4-dimethoxyphenyl)-2-(prop-2-enylamino)acetonitrile Traditional Name: (2S)-2-(allylamino)-2-(2,4-dimethoxyphenyl)acetonitrile Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(C#N)NCC=C)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@@H](C#N)NCC=C)OC

InChI

InChI=1S/C13H16N2O2/c1-4-7-15-12(9-14)11-6-5-10(16-2)8-13(11)17-3/h4-6,8,12,15H,1,7H2,2-3H3/t12-/m1/s1