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2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]isoindole-1,3-dione hydrochloride

2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]isoindole-1,3-dione hydrochloride

Systemtic Name:2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]isoindole-1,3-dione hydrochloride
Openeye Name:2-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]isoindoline-1,3-dione hydrochloride
CAS Name:2-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]isoindole-1,3-dione hydrochloride
IUPAC Name:2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]isoindole-1,3-dione hydrochloride
Traditional Name:2-[2-(4-benzylpiperazino)-2-keto-ethyl]isoindoline-1,3-quinone hydrochloride
Formula: C21H22ClN3O3
MolecularWeight: 399.87068
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4C3=O.Cl


Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)C4=CC=CC=C4C3=O.Cl


InChI

InChI=1S/C21H21N3O3.ClH/c25-19(15-24-20(26)17-8-4-5-9-18(17)21(24)27)23-12-10-22(11-13-23)14-16-6-2-1-3-7-16;/h1-9H,10-15H2;1H


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