2-[4-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-1-yl]ethanenitrile dihydrochloride

Systemtic Name: 2-[4-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-1-yl]ethanenitrile dihydrochloride Openeye Name: 2-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-1-yl]acetonitrile dihydrochloride CAS Name: 2-[4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1-piperazinyl]acetonitrile dihydrochloride IUPAC Name: 2-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazin-1-yl]acetonitrile dihydrochloride Traditional Name: 2-[4-[2-keto-2-(4-phenylpiperazino)ethyl]piperazino]acetonitrile dihydrochloride Formula: C18H27Cl2N5O MolecularWeight: 400.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)CC(=O)N2CCN(CC2)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC#N)CC(=O)N2CCN(CC2)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C18H25N5O.2ClH/c19-6-7-20-8-10-21(11-9-20)16-18(24)23-14-12-22(13-15-23)17-4-2-1-3-5-17;;/h1-5H,7-16H2;2*1H