methyl 3-(4-methoxyphenyl)-1-methyl-6-oxidanylidene-pyridazin-1-ium-1-carboxylate

Systemtic Name: methyl 3-(4-methoxyphenyl)-1-methyl-6-oxidanylidene-pyridazin-1-ium-1-carboxylate Openeye Name: methyl 3-(4-methoxyphenyl)-1-methyl-6-oxo-pyridazin-1-ium-1-carboxylate CAS Name: 3-(4-methoxyphenyl)-1-methyl-6-oxo-1-pyridazin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-(4-methoxyphenyl)-1-methyl-6-oxopyridazin-1-ium-1-carboxylate Traditional Name: 6-keto-3-(4-methoxyphenyl)-1-methyl-pyridazin-1-ium-1-carboxylic acid methyl ester Formula: C14H15N2O4+ MolecularWeight: 275.2799

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)C=CC(=N1)C2=CC=C(C=C2)OC)C(=O)OC

Isomeric SMILES

C[N+]1(C(=O)C=CC(=N1)C2=CC=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C14H15N2O4/c1-16(14(18)20-3)13(17)9-8-12(15-16)10-4-6-11(19-2)7-5-10/h4-9H,1-3H3/q+1