4,5-dimethoxy-2-(phenylmethyl)-4H-pyridazin-2-ium-3-one

Systemtic Name: 4,5-dimethoxy-2-(phenylmethyl)-4H-pyridazin-2-ium-3-one Openeye Name: 2-benzyl-4,5-dimethoxy-4H-pyridazin-2-ium-3-one CAS Name: 4,5-dimethoxy-2-(phenylmethyl)-4H-pyridazin-2-ium-3-one IUPAC Name: 2-benzyl-4,5-dimethoxy-4H-pyridazin-2-ium-3-one Traditional Name: 2-benzyl-4,5-dimethoxy-4H-pyridazin-2-ium-3-one Formula: C13H15N2O3+ MolecularWeight: 247.2698

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(=CN=[N+](C1=O)CC2=CC=CC=C2)OC

Isomeric SMILES

COC1C(=CN=[N+](C1=O)CC2=CC=CC=C2)OC

InChI

InChI=1S/C13H15N2O3/c1-17-11-8-14-15(13(16)12(11)18-2)9-10-6-4-3-5-7-10/h3-8,12H,9H2,1-2H3/q+1