(3E)-3-[(3-morpholin-4-ylpropylamino)-oxidanyl-methylidene]-1H-quinoline-2,4-dione hydrochloride

Systemtic Name: (3E)-3-[(3-morpholin-4-ylpropylamino)-oxidanyl-methylidene]-1H-quinoline-2,4-dione hydrochloride Openeye Name: (3E)-3-[hydroxy-(3-morpholinopropylamino)methylene]-1H-quinoline-2,4-dione hydrochloride CAS Name: (3E)-3-[hydroxy-[3-(4-morpholinyl)propylamino]methylidene]-1H-quinoline-2,4-dione hydrochloride IUPAC Name: (3E)-3-[hydroxy-(3-morpholin-4-ylpropylamino)methylidene]-1H-quinoline-2,4-dione hydrochloride Traditional Name: (3E)-3-[hydroxy-(3-morpholinopropylamino)methylene]-1H-quinoline-2,4-quinone hydrochloride Formula: C17H22ClN3O4 MolecularWeight: 367.82728

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=C2C(=O)C3=CC=CC=C3NC2=O)O.Cl

Isomeric SMILES

C1COCCN1CCCN/C(=C\2/C(=O)C3=CC=CC=C3NC2=O)/O.Cl

InChI

InChI=1S/C17H21N3O4.ClH/c21-15-12-4-1-2-5-13(12)19-17(23)14(15)16(22)18-6-3-7-20-8-10-24-11-9-20;/h1-2,4-5,18,22H,3,6-11H2,(H,19,23);1H/b16-14+;