2-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]isoindole-1,3-dione hydrochloride

Systemtic Name: 2-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]isoindole-1,3-dione hydrochloride Openeye Name: 2-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]isoindoline-1,3-dione hydrochloride CAS Name: 2-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]isoindole-1,3-dione hydrochloride Traditional Name: 2-[3-keto-3-(4-phenylpiperazino)propyl]isoindoline-1,3-quinone hydrochloride Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O.Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O.Cl

InChI

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