2-[5-(2-chloranylethanoyl)-1,3,2-dithiazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-(2-chloranylethanoyl)-1,3,2-dithiazol-4-yl]ethanoic acid Openeye Name: 2-[5-(2-chloroacetyl)-1,3,2-dithiazol-4-yl]acetic acid CAS Name: 2-[5-(2-chloro-1-oxoethyl)-1,3,2-dithiazol-4-yl]acetic acid IUPAC Name: 2-[5-(2-chloroacetyl)-1,3,2-dithiazol-4-yl]acetic acid Traditional Name: 2-[5-(2-chloroacetyl)-1,3,2-dithiazol-4-yl]acetic acid Formula: C6H6ClNO3S2 MolecularWeight: 239.69974

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=C(SNS1)C(=O)CCl)C(=O)O

Isomeric SMILES

C(C1=C(SNS1)C(=O)CCl)C(=O)O

InChI

InChI=1S/C6H6ClNO3S2/c7-2-3(9)6-4(1-5(10)11)12-8-13-6/h8H,1-2H2,(H,10,11)