4-[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 4-(4,5-dichloro-6-oxo-pyridazin-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-(4,5-dichloro-6-oxo-1-pyridazinyl)-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-(4,5-dichloro-6-oxopyridazin-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 4-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C18H21Cl2N4O3+ MolecularWeight: 412.29034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=C(C=C2)N3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=C(C=C2)N3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C18H20Cl2N4O3/c19-15-12-22-24(18(26)16(15)20)14-4-2-13(3-5-14)17(25)21-6-1-7-23-8-10-27-11-9-23/h2-5,12H,1,6-11H2,(H,21,25)/p+1