N-[(3-bromophenyl)-diphenoxyphosphoryl-methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(3-bromophenyl)-diphenoxyphosphoryl-methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(3-bromophenyl)-diphenoxyphosphoryl-methyl]-4-methyl-benzenesulfonamide CAS Name: N-[(3-bromophenyl)-diphenoxyphosphorylmethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(3-bromophenyl)-diphenoxyphosphorylmethyl]-4-methylbenzenesulfonamide Traditional Name: N-[(3-bromophenyl)-diphenoxyphosphoryl-methyl]-4-methyl-benzenesulfonamide Formula: C26H23BrNO5PS MolecularWeight: 572.407281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC(=CC=C2)Br)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC(=CC=C2)Br)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H23BrNO5PS/c1-20-15-17-25(18-16-20)35(30,31)28-26(21-9-8-10-22(27)19-21)34(29,32-23-11-4-2-5-12-23)33-24-13-6-3-7-14-24/h2-19,26,28H,1H3