N-[(5-tert-butyl-3-methylsulfonyl-2-oxidanyl-phenyl)methyl]-2-chloranyl-ethanamide

Systemtic Name: N-[(5-tert-butyl-3-methylsulfonyl-2-oxidanyl-phenyl)methyl]-2-chloranyl-ethanamide Openeye Name: N-[(5-tert-butyl-2-hydroxy-3-methylsulfonyl-phenyl)methyl]-2-chloro-acetamide CAS Name: N-[(5-tert-butyl-2-hydroxy-3-methylsulfonylphenyl)methyl]-2-chloroacetamide IUPAC Name: N-[(5-tert-butyl-2-hydroxy-3-methylsulfonylphenyl)methyl]-2-chloroacetamide Traditional Name: N-(5-tert-butyl-2-hydroxy-3-mesyl-benzyl)-2-chloro-acetamide Formula: C14H20ClNO4S MolecularWeight: 333.8309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)S(=O)(=O)C)O)CNC(=O)CCl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)S(=O)(=O)C)O)CNC(=O)CCl

InChI

InChI=1S/C14H20ClNO4S/c1-14(2,3)10-5-9(8-16-12(17)7-15)13(18)11(6-10)21(4,19)20/h5-6,18H,7-8H2,1-4H3,(H,16,17)