4-(4-bromophenyl)-N-[5-(hydroxymethyl)-2-methoxy-phenyl]benzenesulfonamide

Systemtic Name: 4-(4-bromophenyl)-N-[5-(hydroxymethyl)-2-methoxy-phenyl]benzenesulfonamide Openeye Name: 4-(4-bromophenyl)-N-[5-(hydroxymethyl)-2-methoxy-phenyl]benzenesulfonamide CAS Name: 4-(4-bromophenyl)-N-[5-(hydroxymethyl)-2-methoxyphenyl]benzenesulfonamide IUPAC Name: 4-(4-bromophenyl)-N-[5-(hydroxymethyl)-2-methoxyphenyl]benzenesulfonamide Traditional Name: 4-(4-bromophenyl)-N-(2-methoxy-5-methylol-phenyl)benzenesulfonamide Formula: C20H18BrNO4S MolecularWeight: 448.33022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CO)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CO)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrNO4S/c1-26-20-11-2-14(13-23)12-19(20)22-27(24,25)18-9-5-16(6-10-18)15-3-7-17(21)8-4-15/h2-12,22-23H,13H2,1H3