4-(3-methyl-2-oxidanylidene-1,3-benzothiazol-6-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(3-methyl-2-oxidanylidene-1,3-benzothiazol-6-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)-4-oxo-butanoic acid CAS Name: 4-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)-4-oxobutanoic acid IUPAC Name: 4-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)-4-oxobutanoic acid Traditional Name: 4-keto-4-(2-keto-3-methyl-1,3-benzothiazol-6-yl)butyric acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)CCC(=O)O)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)CCC(=O)O)SC1=O

InChI

InChI=1S/C12H11NO4S/c1-13-8-3-2-7(6-10(8)18-12(13)17)9(14)4-5-11(15)16/h2-3,6H,4-5H2,1H3,(H,15,16)