2-(2-ethyl-3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoic acid

Systemtic Name: 2-(2-ethyl-3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoic acid Openeye Name: 2-(2-ethyl-3-oxo-1,4-benzothiazin-4-yl)acetic acid CAS Name: 2-(2-ethyl-3-oxo-1,4-benzothiazin-4-yl)acetic acid IUPAC Name: 2-(2-ethyl-3-oxo-1,4-benzothiazin-4-yl)acetic acid Traditional Name: 2-(2-ethyl-3-keto-1,4-benzothiazin-4-yl)acetic acid Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CC=CC=C2S1)CC(=O)O

Isomeric SMILES

CCC1C(=O)N(C2=CC=CC=C2S1)CC(=O)O

InChI

InChI=1S/C12H13NO3S/c1-2-9-12(16)13(7-11(14)15)8-5-3-4-6-10(8)17-9/h3-6,9H,2,7H2,1H3,(H,14,15)