N-[5-(2-bromanylethanoyl)-2-phenylmethoxy-phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[5-(2-bromanylethanoyl)-2-phenylmethoxy-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-benzyloxy-5-(2-bromoacetyl)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[5-(2-bromo-1-oxoethyl)-2-phenylmethoxyphenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[5-(2-bromoacetyl)-2-phenylmethoxyphenyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-benzoxy-5-(2-bromoacetyl)phenyl]-4-methyl-benzenesulfonamide Formula: C22H20BrNO4S MolecularWeight: 474.3675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)CBr)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)CBr)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20BrNO4S/c1-16-7-10-19(11-8-16)29(26,27)24-20-13-18(21(25)14-23)9-12-22(20)28-15-17-5-3-2-4-6-17/h2-13,24H,14-15H2,1H3