N-[(3R,4R)-3-bromanyl-2-oxidanylidene-heptan-4-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(3R,4R)-3-bromanyl-2-oxidanylidene-heptan-4-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-bromo-3-oxo-1-propyl-butyl]-4-methyl-benzenesulfonamide CAS Name: N-[(3R,4R)-3-bromo-2-oxoheptan-4-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(3R,4R)-3-bromo-2-oxoheptan-4-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-bromo-3-keto-1-propyl-butyl]-4-methyl-benzenesulfonamide Formula: C14H20BrNO3S MolecularWeight: 362.2825

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C(=O)C)Br)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCC[C@H]([C@H](C(=O)C)Br)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H20BrNO3S/c1-4-5-13(14(15)11(3)17)16-20(18,19)12-8-6-10(2)7-9-12/h6-9,13-14,16H,4-5H2,1-3H3/t13-,14+/m1/s1