2-(3-methylidene-6-oxidanylidene-pyridazin-1-ium-1-yl)propanoic acid

Systemtic Name: 2-(3-methylidene-6-oxidanylidene-pyridazin-1-ium-1-yl)propanoic acid Openeye Name: 2-(3-methylene-6-oxo-pyridazin-1-ium-1-yl)propanoic acid CAS Name: 2-(3-methylene-6-oxo-1-pyridazin-1-iumyl)propanoic acid IUPAC Name: 2-(3-methylidene-6-oxopyridazin-1-ium-1-yl)propanoic acid Traditional Name: 2-(6-keto-3-methylene-pyridazin-1-ium-1-yl)propionic acid Formula: C8H9N2O3+ MolecularWeight: 181.16866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)[N+]1=NC(=C)C=CC1=O

Isomeric SMILES

CC(C(=O)O)[N+]1=NC(=C)C=CC1=O

InChI

InChI=1S/C8H8N2O3/c1-5-3-4-7(11)10(9-5)6(2)8(12)13/h3-4,6H,1H2,2H3/p+1