2-[[2,3-dimethoxy-5-(4-propylpiperazin-1-yl)carbonyl-phenyl]methyl]isoindole-1,3-dione hydrochloride

Systemtic Name: 2-[[2,3-dimethoxy-5-(4-propylpiperazin-1-yl)carbonyl-phenyl]methyl]isoindole-1,3-dione hydrochloride Openeye Name: 2-[[2,3-dimethoxy-5-(4-propylpiperazine-1-carbonyl)phenyl]methyl]isoindoline-1,3-dione hydrochloride CAS Name: 2-[[2,3-dimethoxy-5-[oxo-(4-propyl-1-piperazinyl)methyl]phenyl]methyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-[[2,3-dimethoxy-5-(4-propylpiperazine-1-carbonyl)phenyl]methyl]isoindole-1,3-dione hydrochloride Traditional Name: 2-[2,3-dimethoxy-5-(4-propylpiperazine-1-carbonyl)benzyl]isoindoline-1,3-quinone hydrochloride Formula: C25H30ClN3O5 MolecularWeight: 487.9758

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)OC)CN3C(=O)C4=CC=CC=C4C3=O.Cl

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)OC)CN3C(=O)C4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C25H29N3O5.ClH/c1-4-9-26-10-12-27(13-11-26)23(29)17-14-18(22(33-3)21(15-17)32-2)16-28-24(30)19-7-5-6-8-20(19)25(28)31;/h5-8,14-15H,4,9-13,16H2,1-3H3;1H