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

Systemtic Name: 3-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]propanoic acid Openeye Name: 3-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]propanoic acid CAS Name: 3-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]propanoic acid IUPAC Name: 3-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]propanoic acid Traditional Name: 3-[(2R)-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:

C1=CC=C2C(=C1)NC(=O)C(S2)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)[C@H](S2)CCC(=O)O

InChI

InChI=1S/C11H11NO3S/c13-10(14)6-5-9-11(15)12-7-3-1-2-4-8(7)16-9/h1-4,9H,5-6H2,(H,12,15)(H,13,14)/t9-/m1/s1