2-[3-[(1-oxidanylidene-3,4-dihydro-2H-isoquinolin-5-yl)oxy]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(1-oxidanylidene-3,4-dihydro-2H-isoquinolin-5-yl)oxy]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[(1-oxo-3,4-dihydro-2H-isoquinolin-5-yl)oxy]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[(1-oxo-3,4-dihydro-2H-isoquinolin-5-yl)oxy]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[(1-oxo-3,4-dihydro-2H-isoquinolin-5-yl)oxy]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[(1-keto-3,4-dihydro-2H-isoquinolin-5-yl)oxy]propyl]isoindoline-1,3-quinone Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=C1C(=CC=C2)OCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CNC(=O)C2=C1C(=CC=C2)OCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H18N2O4/c23-18-14-7-3-8-17(13(14)9-10-21-18)26-12-4-11-22-19(24)15-5-1-2-6-16(15)20(22)25/h1-3,5-8H,4,9-12H2,(H,21,23)