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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2S1)CCCC(=O)O

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2S1)CCCC(=O)O

InChI

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