3-[2-methyl-4-oxidanyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-3-yl]propanoic acid

Systemtic Name: 3-[2-methyl-4-oxidanyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-3-yl]propanoic acid Openeye Name: 3-(4-hydroxy-2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)propanoic acid CAS Name: 3-(4-hydroxy-2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)propanoic acid IUPAC Name: 3-(4-hydroxy-2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)propanoic acid Traditional Name: 3-(4-hydroxy-1,1-diketo-2-methyl-1$l^{6},2-benzothiazin-3-yl)propionic acid Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)CCC(=O)O

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)CCC(=O)O

InChI

InChI=1S/C12H13NO5S/c1-13-9(6-7-11(14)15)12(16)8-4-2-3-5-10(8)19(13,17)18/h2-5,16H,6-7H2,1H3,(H,14,15)