2-(1-isoquinolin-1-ylpropyl)isoindole-1,3-dione hydrochloride

Systemtic Name: 2-(1-isoquinolin-1-ylpropyl)isoindole-1,3-dione hydrochloride Openeye Name: 2-[1-(1-isoquinolyl)propyl]isoindoline-1,3-dione hydrochloride CAS Name: 2-[1-(1-isoquinolinyl)propyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-(1-isoquinolin-1-ylpropyl)isoindole-1,3-dione hydrochloride Traditional Name: 2-[1-(1-isoquinolyl)propyl]isoindoline-1,3-quinone hydrochloride Formula: C20H17ClN2O2 MolecularWeight: 352.81418

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC=CC2=CC=CC=C21)N3C(=O)C4=CC=CC=C4C3=O.Cl

Isomeric SMILES

CCC(C1=NC=CC2=CC=CC=C21)N3C(=O)C4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C20H16N2O2.ClH/c1-2-17(18-14-8-4-3-7-13(14)11-12-21-18)22-19(23)15-9-5-6-10-16(15)20(22)24;/h3-12,17H,2H2,1H3;1H