N-[2-(2-bromanylpropanoyl)-4,5-dimethoxy-phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-(2-bromanylpropanoyl)-4,5-dimethoxy-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(2-bromopropanoyl)-4,5-dimethoxy-phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-(2-bromo-1-oxopropyl)-4,5-dimethoxyphenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(2-bromopropanoyl)-4,5-dimethoxyphenyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(2-bromopropanoyl)-4,5-dimethoxy-phenyl]-4-methyl-benzenesulfonamide Formula: C18H20BrNO5S MolecularWeight: 442.3241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)C(C)Br)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)C(C)Br)OC)OC

InChI

InChI=1S/C18H20BrNO5S/c1-11-5-7-13(8-6-11)26(22,23)20-15-10-17(25-4)16(24-3)9-14(15)18(21)12(2)19/h5-10,12,20H,1-4H3