3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxidanylidene-propanoic acid Openeye Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxo-propanoic acid CAS Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxopropanoic acid IUPAC Name: 3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-3-oxopropanoic acid Traditional Name: 3-keto-3-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)propionic acid Formula: C12H13NO3S MolecularWeight: 251.30152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCSC2=C1C=C(C=C2)C(=O)CC(=O)O

Isomeric SMILES

CN1CCSC2=C1C=C(C=C2)C(=O)CC(=O)O

InChI

InChI=1S/C12H13NO3S/c1-13-4-5-17-11-3-2-8(6-9(11)13)10(14)7-12(15)16/h2-3,6H,4-5,7H2,1H3,(H,15,16)