2-(1,3-benzodioxol-5-yl)-2-[(phenylmethyl)amino]ethanenitrile hydrochloride

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-[(phenylmethyl)amino]ethanenitrile hydrochloride Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(benzylamino)acetonitrile hydrochloride CAS Name: 2-(1,3-benzodioxol-5-yl)-2-[(phenylmethyl)amino]acetonitrile hydrochloride IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(benzylamino)acetonitrile hydrochloride Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(benzylamino)acetonitrile hydrochloride Formula: C16H15ClN2O2 MolecularWeight: 302.7555

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C#N)NCC3=CC=CC=C3.Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C#N)NCC3=CC=CC=C3.Cl

InChI

InChI=1S/C16H14N2O2.ClH/c17-9-14(18-10-12-4-2-1-3-5-12)13-6-7-15-16(8-13)20-11-19-15;/h1-8,14,18H,10-11H2;1H