N-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpyrrolidin-3-yl]-2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: N-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpyrrolidin-3-yl]-2,2,2-tris(fluoranyl)ethanamide Openeye Name: N-[1-(5-bromo-2-methoxy-phenyl)sulfonylpyrrolidin-3-yl]-2,2,2-trifluoro-acetamide CAS Name: N-[1-(5-bromo-2-methoxyphenyl)sulfonyl-3-pyrrolidinyl]-2,2,2-trifluoroacetamide IUPAC Name: N-[1-(5-bromo-2-methoxyphenyl)sulfonylpyrrolidin-3-yl]-2,2,2-trifluoroacetamide Traditional Name: N-[1-(5-bromo-2-methoxy-phenyl)sulfonylpyrrolidin-3-yl]-2,2,2-trifluoro-acetamide Formula: C13H14BrF3N2O4S MolecularWeight: 431.22547

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(C2)NC(=O)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(C2)NC(=O)C(F)(F)F

InChI

InChI=1S/C13H14BrF3N2O4S/c1-23-10-3-2-8(14)6-11(10)24(21,22)19-5-4-9(7-19)18-12(20)13(15,16)17/h2-3,6,9H,4-5,7H2,1H3,(H,18,20)