(2S)-2-(prop-2-enylamino)-2-(3,4,5-trimethoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(prop-2-enylamino)-2-(3,4,5-trimethoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(allylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile CAS Name: (2S)-2-(prop-2-enylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(prop-2-enylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile Traditional Name: (2S)-2-(allylamino)-2-(3,4,5-trimethoxyphenyl)acetonitrile Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C#N)NCC=C

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@@H](C#N)NCC=C

InChI

InChI=1S/C14H18N2O3/c1-5-6-16-11(9-15)10-7-12(17-2)14(19-4)13(8-10)18-3/h5,7-8,11,16H,1,6H2,2-4H3/t11-/m1/s1