(2S)-2-(1,3-benzodioxol-5-yl)-2-(ethylamino)ethanenitrile

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-yl)-2-(ethylamino)ethanenitrile Openeye Name: (2S)-2-(1,3-benzodioxol-5-yl)-2-(ethylamino)acetonitrile CAS Name: (2S)-2-(1,3-benzodioxol-5-yl)-2-(ethylamino)acetonitrile IUPAC Name: (2S)-2-(1,3-benzodioxol-5-yl)-2-(ethylamino)acetonitrile Traditional Name: (2S)-2-(1,3-benzodioxol-5-yl)-2-(ethylamino)acetonitrile Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C#N)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCN[C@H](C#N)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H12N2O2/c1-2-13-9(6-12)8-3-4-10-11(5-8)15-7-14-10/h3-5,9,13H,2,7H2,1H3/t9-/m1/s1