zinc 5-chloranyl-2-methyl-1,2-thiazol-3-one ethanoate

Systemtic Name: zinc 5-chloranyl-2-methyl-1,2-thiazol-3-one ethanoate Openeye Name: zinc 5-chloro-2-methyl-isothiazol-3-one acetate CAS Name: zinc 5-chloro-2-methyl-3-isothiazolone acetate IUPAC Name: zinc 5-chloro-2-methyl-1,2-thiazol-3-one acetate Traditional Name: zinc 5-chloro-2-methyl-4-isothiazolin-3-one acetate Formula: C6H7ClNO3SZn+ MolecularWeight: 274.05168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CN1C(=O)C=C(S1)Cl.[Zn+2]

Isomeric SMILES

CC(=O)[O-].CN1C(=O)C=C(S1)Cl.[Zn+2]

InChI

InChI=1S/C4H4ClNOS.C2H4O2.Zn/c1-6-4(7)2-3(5)8-6;1-2(3)4;/h2H,1H3;1H3,(H,3,4);/q;;+2/p-1