2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)propanoic acid

Systemtic Name: 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)propanoic acid Openeye Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoic acid CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoic acid IUPAC Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanoic acid Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)propionic acid Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)NC2=CC=CC=C2S1)C(=O)O

Isomeric SMILES

CC(C1C(=O)NC2=CC=CC=C2S1)C(=O)O

InChI

InChI=1S/C11H11NO3S/c1-6(11(14)15)9-10(13)12-7-4-2-3-5-8(7)16-9/h2-6,9H,1H3,(H,12,13)(H,14,15)