(2S)-3-bromanyl-2-methyl-2-oxidanyl-N-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]propanamide

Systemtic Name: (2S)-3-bromanyl-2-methyl-2-oxidanyl-N-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]propanamide Openeye Name: (2S)-3-bromo-2-hydroxy-2-methyl-N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]propanamide CAS Name: (2S)-3-bromo-2-hydroxy-2-methyl-N-[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]propanamide IUPAC Name: (2S)-3-bromo-2-hydroxy-2-methyl-N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]propanamide Traditional Name: (2S)-3-bromo-2-hydroxy-N-[2-keto-4-(trifluoromethyl)chromen-7-yl]-2-methyl-propionamide Formula: C14H11BrF3NO4 MolecularWeight: 394.14065

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Descriptors Computed from Structure

Canonical SMILES:

CC(CBr)(C(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F)O

Isomeric SMILES

C[C@@](CBr)(C(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F)O

InChI

InChI=1S/C14H11BrF3NO4/c1-13(22,6-15)12(21)19-7-2-3-8-9(14(16,17)18)5-11(20)23-10(8)4-7/h2-5,22H,6H2,1H3,(H,19,21)/t13-/m1/s1