3-[6-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoic acid

Systemtic Name: 3-[6-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoic acid Openeye Name: 3-[6-(2-methylthiazol-4-yl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid CAS Name: 3-[6-(2-methyl-4-thiazolyl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid IUPAC Name: 3-[6-(2-methyl-1,3-thiazol-4-yl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid Traditional Name: 3-[3-keto-6-(2-methylthiazol-4-yl)-1,4-benzoxazin-4-yl]propionic acid Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC3=C(C=C2)OCC(=O)N3CCC(=O)O

Isomeric SMILES

CC1=NC(=CS1)C2=CC3=C(C=C2)OCC(=O)N3CCC(=O)O

InChI

InChI=1S/C15H14N2O4S/c1-9-16-11(8-22-9)10-2-3-13-12(6-10)17(5-4-15(19)20)14(18)7-21-13/h2-3,6,8H,4-5,7H2,1H3,(H,19,20)