3-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonylbenzoic acid

Systemtic Name: 3-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonylbenzoic acid Openeye Name: 3-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]sulfonylbenzoic acid CAS Name: 3-[4-(5-acetyl-4-methyl-2-thiazolyl)phenoxy]sulfonylbenzoic acid IUPAC Name: 3-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonylbenzoic acid Traditional Name: 3-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]sulfonylbenzoic acid Formula: C19H15NO6S2 MolecularWeight: 417.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C(=O)O)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C(=O)O)C(=O)C

InChI

InChI=1S/C19H15NO6S2/c1-11-17(12(2)21)27-18(20-11)13-6-8-15(9-7-13)26-28(24,25)16-5-3-4-14(10-16)19(22)23/h3-10H,1-2H3,(H,22,23)