4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxo-butanoic acid CAS Name: 4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxobutanoic acid IUPAC Name: 4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxobutanoic acid Traditional Name: 4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-keto-butyric acid Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2N1C(=O)CCC(=O)O

Isomeric SMILES

C1CSC2=CC=CC=C2N1C(=O)CCC(=O)O

InChI

InChI=1S/C12H13NO3S/c14-11(5-6-12(15)16)13-7-8-17-10-4-2-1-3-9(10)13/h1-4H,5-8H2,(H,15,16)