sodium (2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-hydroxyimino-ethanoate dihydrate

Systemtic Name: sodium (2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-hydroxyimino-ethanoate dihydrate Openeye Name: sodium (2Z)-2-(2-aminothiazol-4-yl)-2-hydroxyimino-acetate dihydrate CAS Name: sodium (2Z)-2-(2-amino-4-thiazolyl)-2-hydroxyiminoacetate dihydrate IUPAC Name: sodium (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetate dihydrate Traditional Name: sodium (2Z)-2-(2-aminothiazol-4-yl)-2-hydroximino-acetate dihydrate Formula: C5H8N3NaO5S MolecularWeight: 245.18889

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)N)C(=NO)C(=O)[O-].O.O.[Na+]

Isomeric SMILES

C1=C(N=C(S1)N)/C(=N/O)/C(=O)[O-].O.O.[Na+]

InChI

InChI=1S/C5H5N3O3S.Na.2H2O/c6-5-7-2(1-12-5)3(8-11)4(9)10;;;/h1,11H,(H2,6,7)(H,9,10);;2*1H2/q;+1;;/p-1/b8-3-;;;