N-[4-(2-methylbutanoyl)phenyl]methanesulfonamide

Systemtic Name: N-[4-(2-methylbutanoyl)phenyl]methanesulfonamide Openeye Name: N-[4-(2-methylbutanoyl)phenyl]methanesulfonamide CAS Name: N-[4-(2-methyl-1-oxobutyl)phenyl]methanesulfonamide IUPAC Name: N-[4-(2-methylbutanoyl)phenyl]methanesulfonamide Traditional Name: N-[4-(2-methylbutanoyl)phenyl]methanesulfonamide Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C1=CC=C(C=C1)NS(=O)(=O)C

Isomeric SMILES

CCC(C)C(=O)C1=CC=C(C=C1)NS(=O)(=O)C

InChI

InChI=1S/C12H17NO3S/c1-4-9(2)12(14)10-5-7-11(8-6-10)13-17(3,15)16/h5-9,13H,4H2,1-3H3