3-[[4-chloranyl-3-(4-methyl-1-oxidanidyl-pyridin-1-ium-2-yl)oxy-phenyl]methyl]-5-methyl-1H-pyridazin-6-one

Systemtic Name: 3-[[4-chloranyl-3-(4-methyl-1-oxidanidyl-pyridin-1-ium-2-yl)oxy-phenyl]methyl]-5-methyl-1H-pyridazin-6-one Openeye Name: 3-[[4-chloro-3-(4-methyl-1-oxido-pyridin-1-ium-2-yl)oxy-phenyl]methyl]-5-methyl-1H-pyridazin-6-one CAS Name: 3-[[4-chloro-3-[(4-methyl-1-oxido-2-pyridin-1-iumyl)oxy]phenyl]methyl]-5-methyl-1H-pyridazin-6-one IUPAC Name: 3-[[4-chloro-3-(4-methyl-1-oxidopyridin-1-ium-2-yl)oxyphenyl]methyl]-5-methyl-1H-pyridazin-6-one Traditional Name: 3-[4-chloro-3-(4-methyl-1-oxido-pyridin-1-ium-2-yl)oxy-benzyl]-5-methyl-1H-pyridazin-6-one Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C=C1)[O-])OC2=C(C=CC(=C2)CC3=NNC(=O)C(=C3)C)Cl

Isomeric SMILES

CC1=CC(=[N+](C=C1)[O-])OC2=C(C=CC(=C2)CC3=NNC(=O)C(=C3)C)Cl

InChI

InChI=1S/C18H16ClN3O3/c1-11-5-6-22(24)17(7-11)25-16-10-13(3-4-15(16)19)9-14-8-12(2)18(23)21-20-14/h3-8,10H,9H2,1-2H3,(H,21,23)