(2E)-2-[(4-methyl-2-oxidanylidene-7-sulfonyl-6H-1,3-benzothiazol-3-yl)hydrazinylidene]ethanoic acid

Systemtic Name: (2E)-2-[(4-methyl-2-oxidanylidene-7-sulfonyl-6H-1,3-benzothiazol-3-yl)hydrazinylidene]ethanoic acid Openeye Name: (2E)-2-[(4-methyl-2-oxo-7-sulfonyl-6H-1,3-benzothiazol-3-yl)hydrazono]acetic acid CAS Name: (2E)-2-[(4-methyl-2-oxo-7-sulfonyl-6H-1,3-benzothiazol-3-yl)hydrazinylidene]acetic acid IUPAC Name: (2E)-2-[(4-methyl-2-oxo-7-sulfonyl-6H-1,3-benzothiazol-3-yl)hydrazinylidene]acetic acid Traditional Name: (2E)-2-[(2-keto-4-methyl-7-sulfonyl-6H-1,3-benzothiazol-3-yl)hydrazono]acetic acid Formula: C10H9N3O5S2 MolecularWeight: 315.32556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(=S(=O)=O)C2=C1N(C(=O)S2)NN=CC(=O)O

Isomeric SMILES

CC1=CCC(=S(=O)=O)C2=C1N(C(=O)S2)N/N=C/C(=O)O

InChI

InChI=1S/C10H9N3O5S2/c1-5-2-3-6(20(17)18)9-8(5)13(10(16)19-9)12-11-4-7(14)15/h2,4,12H,3H2,1H3,(H,14,15)/b11-4+