2-[2-(7-chloranyl-4-oxidanylidene-1,3-benzothiazin-2-yl)-6-methyl-pyridin-4-yl]propanoic acid

Systemtic Name: 2-[2-(7-chloranyl-4-oxidanylidene-1,3-benzothiazin-2-yl)-6-methyl-pyridin-4-yl]propanoic acid Openeye Name: 2-[2-(7-chloro-4-oxo-1,3-benzothiazin-2-yl)-6-methyl-4-pyridyl]propanoic acid CAS Name: 2-[2-(7-chloro-4-oxo-1,3-benzothiazin-2-yl)-6-methyl-4-pyridinyl]propanoic acid IUPAC Name: 2-[2-(7-chloro-4-oxo-1,3-benzothiazin-2-yl)-6-methylpyridin-4-yl]propanoic acid Traditional Name: 2-[2-(7-chloro-4-keto-1,3-benzothiazin-2-yl)-6-methyl-4-pyridyl]propionic acid Formula: C17H13ClN2O3S MolecularWeight: 360.81472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C2=NC(=O)C3=C(S2)C=C(C=C3)Cl)C(C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=N1)C2=NC(=O)C3=C(S2)C=C(C=C3)Cl)C(C)C(=O)O

InChI

InChI=1S/C17H13ClN2O3S/c1-8-5-10(9(2)17(22)23)6-13(19-8)16-20-15(21)12-4-3-11(18)7-14(12)24-16/h3-7,9H,1-2H3,(H,22,23)