2-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethanenitrile hydrochloride

Systemtic Name: 2-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethanenitrile hydrochloride Openeye Name: 2-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)acetonitrile hydrochloride CAS Name: 2-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-methyl-1-piperazinyl)acetonitrile hydrochloride IUPAC Name: 2-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)acetonitrile hydrochloride Traditional Name: 2-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-methylpiperazino)acetonitrile hydrochloride Formula: C14H17Cl2N3O2 MolecularWeight: 330.20968

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(C#N)C2=CC3=C(C=C2Cl)OCO3.Cl

Isomeric SMILES

CN1CCN(CC1)C(C#N)C2=CC3=C(C=C2Cl)OCO3.Cl

InChI

InChI=1S/C14H16ClN3O2.ClH/c1-17-2-4-18(5-3-17)12(8-16)10-6-13-14(7-11(10)15)20-9-19-13;/h6-7,12H,2-5,9H2,1H3;1H