2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-2-oxidanyl-3-phenylsulfanyl-propanamide

Systemtic Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-2-oxidanyl-3-phenylsulfanyl-propanamide Openeye Name: 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-3-phenylsulfanyl-propanamide CAS Name: 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-3-(phenylthio)propanamide IUPAC Name: 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-3-phenylsulfanylpropanamide Traditional Name: 2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]-3-(phenylthio)propionamide Formula: C17H15F3N2O4S MolecularWeight: 400.37221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)(C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)O

Isomeric SMILES

CC(CSC1=CC=CC=C1)(C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)O

InChI

InChI=1S/C17H15F3N2O4S/c1-16(24,10-27-12-5-3-2-4-6-12)15(23)21-11-7-8-14(22(25)26)13(9-11)17(18,19)20/h2-9,24H,10H2,1H3,(H,21,23)