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

Systemtic Name: 3-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonyl-4-methyl-benzoic acid Openeye Name: 3-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]sulfonyl-4-methyl-benzoic acid CAS Name: 3-[4-(5-acetyl-4-methyl-2-thiazolyl)phenoxy]sulfonyl-4-methylbenzoic acid IUPAC Name: 3-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)phenoxy]sulfonyl-4-methylbenzoic acid Traditional Name: 3-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]sulfonyl-4-methyl-benzoic acid Formula: C20H17NO6S2 MolecularWeight: 431.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)OC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)OC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)C)C

InChI

InChI=1S/C20H17NO6S2/c1-11-4-5-15(20(23)24)10-17(11)29(25,26)27-16-8-6-14(7-9-16)19-21-12(2)18(28-19)13(3)22/h4-10H,1-3H3,(H,23,24)