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

Systemtic Name: (2S)-2-azanyl-2-(1,3-benzodioxol-5-yl)ethanenitrile Openeye Name: (2S)-2-amino-2-(1,3-benzodioxol-5-yl)acetonitrile CAS Name: (2S)-2-amino-2-(1,3-benzodioxol-5-yl)acetonitrile IUPAC Name: (2S)-2-amino-2-(1,3-benzodioxol-5-yl)acetonitrile Traditional Name: (2S)-2-amino-2-(1,3-benzodioxol-5-yl)acetonitrile Formula: C9H8N2O2 MolecularWeight: 176.17202

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C#N)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@@H](C#N)N

InChI

InChI=1S/C9H8N2O2/c10-4-7(11)6-1-2-8-9(3-6)13-5-12-8/h1-3,7H,5,11H2/t7-/m1/s1