N-(3-bromanyl-6-cyano-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-7-yl)-2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: N-(3-bromanyl-6-cyano-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-7-yl)-2,2,2-tris(fluoranyl)ethanamide Openeye Name: N-(3-bromo-6-cyano-4-hydroxy-2,2-dimethyl-chroman-7-yl)-2,2,2-trifluoro-acetamide CAS Name: N-(3-bromo-6-cyano-4-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-7-yl)-2,2,2-trifluoroacetamide IUPAC Name: N-(3-bromo-6-cyano-4-hydroxy-2,2-dimethyl-3,4-dihydrochromen-7-yl)-2,2,2-trifluoroacetamide Traditional Name: N-(3-bromo-6-cyano-4-hydroxy-2,2-dimethyl-chroman-7-yl)-2,2,2-trifluoro-acetamide Formula: C14H12BrF3N2O3 MolecularWeight: 393.15589

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=C(C(=C2)C#N)NC(=O)C(F)(F)F)O)Br)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=C(C(=C2)C#N)NC(=O)C(F)(F)F)O)Br)C

InChI

InChI=1S/C14H12BrF3N2O3/c1-13(2)11(15)10(21)7-3-6(5-19)8(4-9(7)23-13)20-12(22)14(16,17)18/h3-4,10-11,21H,1-2H3,(H,20,22)