N-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfonyl]-4,4-bis(oxidanyl)-2-oxidanylidene-but-3-enamide

Systemtic Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfonyl]-4,4-bis(oxidanyl)-2-oxidanylidene-but-3-enamide Openeye Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfonyl]-4,4-dihydroxy-2-oxo-but-3-enamide CAS Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfonyl]-4,4-dihydroxy-2-oxo-3-butenamide IUPAC Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfonyl]-4,4-dihydroxy-2-oxobut-3-enamide Traditional Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfonyl]-4,4-dihydroxy-2-keto-but-3-enamide Formula: C13H12N2O7S2 MolecularWeight: 372.37358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)S(=O)(=O)NC(=O)C(=O)C=C(O)O

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)S(=O)(=O)NC(=O)C(=O)C=C(O)O

InChI

InChI=1S/C13H12N2O7S2/c1-2-22-7-3-4-8-10(5-7)23-13(14-8)24(20,21)15-12(19)9(16)6-11(17)18/h3-6,17-18H,2H2,1H3,(H,15,19)