1-[1-(2H-isoindol-1-yl)ethyl]-7,8-dimethoxy-quinazoline-2,4-dione hydrochloride

Systemtic Name: 1-[1-(2H-isoindol-1-yl)ethyl]-7,8-dimethoxy-quinazoline-2,4-dione hydrochloride Openeye Name: 1-[1-(2H-isoindol-1-yl)ethyl]-7,8-dimethoxy-quinazoline-2,4-dione hydrochloride CAS Name: 1-[1-(2H-isoindol-1-yl)ethyl]-7,8-dimethoxyquinazoline-2,4-dione hydrochloride IUPAC Name: 1-[1-(2H-isoindol-1-yl)ethyl]-7,8-dimethoxyquinazoline-2,4-dione hydrochloride Traditional Name: 1-[1-(2H-isoindol-1-yl)ethyl]-7,8-dimethoxy-quinazoline-2,4-quinone hydrochloride Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C=CC=CC2=CN1)N3C4=C(C=CC(=C4OC)OC)C(=O)NC3=O.Cl

Isomeric SMILES

CC(C1=C2C=CC=CC2=CN1)N3C4=C(C=CC(=C4OC)OC)C(=O)NC3=O.Cl

InChI

InChI=1S/C20H19N3O4.ClH/c1-11(16-13-7-5-4-6-12(13)10-21-16)23-17-14(19(24)22-20(23)25)8-9-15(26-2)18(17)27-3;/h4-11,21H,1-3H3,(H,22,24,25);1H