N-(2-chloranyl-4-ethylsulfonyl-phenyl)-3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanamide; N-methylmethanamine

Systemtic Name: N-(2-chloranyl-4-ethylsulfonyl-phenyl)-3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanamide; N-methylmethanamine Openeye Name: N-(2-chloro-4-ethylsulfonyl-phenyl)-3,3,3-trifluoro-2-hydroxy-2-methyl-propanamide; N-methylmethanamine CAS Name: N-(2-chloro-4-ethylsulfonylphenyl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide; N-methylmethanamine IUPAC Name: N-(2-chloro-4-ethylsulfonylphenyl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide; N-methylmethanamine Traditional Name: N-(2-chloro-4-esyl-phenyl)-3,3,3-trifluoro-2-hydroxy-2-methyl-propionamide; dimethylamine Formula: C14H20ClF3N2O4S MolecularWeight: 404.83281

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)NC(=O)C(C)(C(F)(F)F)O)Cl.CNC

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)NC(=O)C(C)(C(F)(F)F)O)Cl.CNC

InChI

InChI=1S/C12H13ClF3NO4S.C2H7N/c1-3-22(20,21)7-4-5-9(8(13)6-7)17-10(18)11(2,19)12(14,15)16;1-3-2/h4-6,19H,3H2,1-2H3,(H,17,18);3H,1-2H3