[4-[(4-methoxyphenyl)methyl-(phenylmethyl)sulfamoyl]phenyl]boronic acid

Systemtic Name: [4-[(4-methoxyphenyl)methyl-(phenylmethyl)sulfamoyl]phenyl]boronic acid Openeye Name: [4-[benzyl-[(4-methoxyphenyl)methyl]sulfamoyl]phenyl]boronic acid CAS Name: [4-[(4-methoxyphenyl)methyl-(phenylmethyl)sulfamoyl]phenyl]boronic acid IUPAC Name: [4-[benzyl-[(4-methoxyphenyl)methyl]sulfamoyl]phenyl]boronic acid Traditional Name: [4-[benzyl(p-anisyl)sulfamoyl]phenyl]boronic acid Formula: C21H22BNO5S MolecularWeight: 411.27908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OC)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OC)(O)O

InChI

InChI=1S/C21H22BNO5S/c1-28-20-11-7-18(8-12-20)16-23(15-17-5-3-2-4-6-17)29(26,27)21-13-9-19(10-14-21)22(24)25/h2-14,24-25H,15-16H2,1H3