methyl 4-(3-methylpyridazin-1-ium-1-yl)benzoate

Systemtic Name: methyl 4-(3-methylpyridazin-1-ium-1-yl)benzoate Openeye Name: methyl 4-(3-methylpyridazin-1-ium-1-yl)benzoate CAS Name: 4-(3-methyl-1-pyridazin-1-iumyl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-methylpyridazin-1-ium-1-yl)benzoate Traditional Name: 4-(3-methylpyridazin-1-ium-1-yl)benzoic acid methyl ester Formula: C13H13N2O2+ MolecularWeight: 229.25452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=CC=C1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=N[N+](=CC=C1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C13H13N2O2/c1-10-4-3-9-15(14-10)12-7-5-11(6-8-12)13(16)17-2/h3-9H,1-2H3/q+1