5-azanyl-2-phenyl-pyridazin-1-ium-3-one; hydron; sulfate

Systemtic Name: 5-azanyl-2-phenyl-pyridazin-1-ium-3-one; hydron; sulfate Openeye Name: 5-amino-2-phenyl-pyridazin-1-ium-3-one; hydron; sulfate CAS Name: 5-amino-2-phenyl-3-pyridazin-1-iumone; hydron; sulfate IUPAC Name: 5-amino-2-phenylpyridazin-1-ium-3-one; hydron; sulfate Traditional Name: 5-amino-2-phenyl-pyridazin-1-ium-3-one; hydron; sulfate Formula: C10H11N3O5S MolecularWeight: 285.27644

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Descriptors Computed from Structure

Canonical SMILES:

[H+].C1=CC=C(C=C1)N2C(=O)C=C(C=[NH+]2)N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

[H+].C1=CC=C(C=C1)N2C(=O)C=C(C=[NH+]2)N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H9N3O.H2O4S/c11-8-6-10(14)13(12-7-8)9-4-2-1-3-5-9;1-5(2,3)4/h1-7H,11H2;(H2,1,2,3,4)