3-azanyl-4,4,4-tris(fluoranyl)-2-(4-methylphenyl)sulfonyl-3-oxidanyl-butanenitrile

Systemtic Name: 3-azanyl-4,4,4-tris(fluoranyl)-2-(4-methylphenyl)sulfonyl-3-oxidanyl-butanenitrile Openeye Name: 3-amino-4,4,4-trifluoro-3-hydroxy-2-(p-tolylsulfonyl)butanenitrile CAS Name: 3-amino-4,4,4-trifluoro-3-hydroxy-2-(4-methylphenyl)sulfonylbutanenitrile IUPAC Name: 3-amino-4,4,4-trifluoro-3-hydroxy-2-(4-methylphenyl)sulfonylbutanenitrile Traditional Name: 3-amino-4,4,4-trifluoro-3-hydroxy-2-tosyl-butyronitrile Formula: C11H11F3N2O3S MolecularWeight: 308.27685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C(C(F)(F)F)(N)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C(C(F)(F)F)(N)O

InChI

InChI=1S/C11H11F3N2O3S/c1-7-2-4-8(5-3-7)20(18,19)9(6-15)10(16,17)11(12,13)14/h2-5,9,17H,16H2,1H3