N-[3-chloranyl-5-methyl-4-(2-methylsulfonyl-4-oxidanyl-phenoxy)phenyl]-2-oxidanyl-ethanamide

Systemtic Name: N-[3-chloranyl-5-methyl-4-(2-methylsulfonyl-4-oxidanyl-phenoxy)phenyl]-2-oxidanyl-ethanamide Openeye Name: N-[3-chloro-4-(4-hydroxy-2-methylsulfonyl-phenoxy)-5-methyl-phenyl]-2-hydroxy-acetamide CAS Name: N-[3-chloro-4-(4-hydroxy-2-methylsulfonylphenoxy)-5-methylphenyl]-2-hydroxyacetamide IUPAC Name: N-[3-chloro-4-(4-hydroxy-2-methylsulfonylphenoxy)-5-methylphenyl]-2-hydroxyacetamide Traditional Name: N-[3-chloro-4-(4-hydroxy-2-mesyl-phenoxy)-5-methyl-phenyl]-2-hydroxy-acetamide Formula: C16H16ClNO6S MolecularWeight: 385.81934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=C(C=C(C=C2)O)S(=O)(=O)C)Cl)NC(=O)CO

Isomeric SMILES

CC1=CC(=CC(=C1OC2=C(C=C(C=C2)O)S(=O)(=O)C)Cl)NC(=O)CO

InChI

InChI=1S/C16H16ClNO6S/c1-9-5-10(18-15(21)8-19)6-12(17)16(9)24-13-4-3-11(20)7-14(13)25(2,22)23/h3-7,19-20H,8H2,1-2H3,(H,18,21)