1-[[methyl-(phenylmethyl)azaniumyl]methyl]-6-oxidanylidene-pyridazin-3-olate

Systemtic Name: 1-[[methyl-(phenylmethyl)azaniumyl]methyl]-6-oxidanylidene-pyridazin-3-olate Openeye Name: 1-[[benzyl(methyl)ammonio]methyl]-6-oxo-pyridazin-3-olate CAS Name: 1-[[methyl-(phenylmethyl)ammonio]methyl]-6-oxo-3-pyridazinolate IUPAC Name: 1-[[benzyl(methyl)azaniumyl]methyl]-6-oxopyridazin-3-olate Traditional Name: 1-[[benzyl(methyl)ammonio]methyl]-6-keto-pyridazin-3-olate Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CN2C(=O)C=CC(=N2)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CN2C(=O)C=CC(=N2)[O-]

InChI

InChI=1S/C13H15N3O2/c1-15(9-11-5-3-2-4-6-11)10-16-13(18)8-7-12(17)14-16/h2-8H,9-10H2,1H3,(H,14,17)