(2R)-2-(1,3-benzodioxol-5-ylmethylamino)-2-(3-methylphenyl)ethanenitrile

Systemtic Name: (2R)-2-(1,3-benzodioxol-5-ylmethylamino)-2-(3-methylphenyl)ethanenitrile Openeye Name: (2R)-2-(1,3-benzodioxol-5-ylmethylamino)-2-(m-tolyl)acetonitrile CAS Name: (2R)-2-(1,3-benzodioxol-5-ylmethylamino)-2-(3-methylphenyl)acetonitrile IUPAC Name: (2R)-2-(1,3-benzodioxol-5-ylmethylamino)-2-(3-methylphenyl)acetonitrile Traditional Name: (2R)-2-(m-tolyl)-2-(piperonylamino)acetonitrile Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C#N)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=CC=C1)[C@H](C#N)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16N2O2/c1-12-3-2-4-14(7-12)15(9-18)19-10-13-5-6-16-17(8-13)21-11-20-16/h2-8,15,19H,10-11H2,1H3/t15-/m0/s1