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

Systemtic Name: 3-[(3-morpholin-4-ium-4-ylpropylamino)-oxidanyl-methylidene]-1H-quinoline-2,4-dione Openeye Name: 3-[hydroxy-(3-morpholin-4-ium-4-ylpropylamino)methylene]-1H-quinoline-2,4-dione CAS Name: 3-[hydroxy-[3-(4-morpholin-4-iumyl)propylamino]methylidene]-1H-quinoline-2,4-dione IUPAC Name: 3-[hydroxy-(3-morpholin-4-ium-4-ylpropylamino)methylidene]-1H-quinoline-2,4-dione Traditional Name: 3-[hydroxy-(3-morpholin-4-ium-4-ylpropylamino)methylene]-1H-quinoline-2,4-quinone Formula: C17H22N3O4+ MolecularWeight: 332.37428

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=C2C(=O)C3=CC=CC=C3NC2=O)O

Isomeric SMILES

C1COCC[NH+]1CCCNC(=C2C(=O)C3=CC=CC=C3NC2=O)O

InChI

InChI=1S/C17H21N3O4/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)/p+1