2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(2,1,3-benzoxadiazol-5-yloxymethyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(benzofurazan-5-yloxymethyl)-4-methyl-thiazole-5-carboxylic acid Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)COC2=CC3=NON=C3C=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)COC2=CC3=NON=C3C=C2)C(=O)O

InChI

InChI=1S/C12H9N3O4S/c1-6-11(12(16)17)20-10(13-6)5-18-7-2-3-8-9(4-7)15-19-14-8/h2-4H,5H2,1H3,(H,16,17)