2-(1,3-benzodioxol-5-yl)-2-morpholin-4-yl-ethanenitrile hydrochloride

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-morpholin-4-yl-ethanenitrile hydrochloride Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-morpholino-acetonitrile hydrochloride CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(4-morpholinyl)acetonitrile hydrochloride IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ylacetonitrile hydrochloride Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-morpholino-acetonitrile hydrochloride Formula: C13H15ClN2O3 MolecularWeight: 282.7228

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(C#N)C2=CC3=C(C=C2)OCO3.Cl

Isomeric SMILES

C1COCCN1C(C#N)C2=CC3=C(C=C2)OCO3.Cl

InChI

InChI=1S/C13H14N2O3.ClH/c14-8-11(15-3-5-16-6-4-15)10-1-2-12-13(7-10)18-9-17-12;/h1-2,7,11H,3-6,9H2;1H