5-chloranyl-4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[(6-morpholinopyridin-1-ium-3-yl)methylamino]-1H-pyridazin-6-one CAS Name: 5-chloro-4-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methylamino]-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[(6-morpholinopyridin-1-ium-3-yl)methylamino]-1H-pyridazin-6-one Formula: C14H17ClN5O2+ MolecularWeight: 322.77008

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC3=C(C(=O)NN=C3)Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC3=C(C(=O)NN=C3)Cl

InChI

InChI=1S/C14H16ClN5O2/c15-13-11(9-18-19-14(13)21)16-7-10-1-2-12(17-8-10)20-3-5-22-6-4-20/h1-2,8-9H,3-7H2,(H2,16,19,21)/p+1