5-[bis(phenylmethyl)sulfamoyl]-2-methoxy-benzenesulfonic acid

Systemtic Name: 5-[bis(phenylmethyl)sulfamoyl]-2-methoxy-benzenesulfonic acid Openeye Name: 5-(dibenzylsulfamoyl)-2-methoxy-benzenesulfonic acid CAS Name: 5-[bis(phenylmethyl)sulfamoyl]-2-methoxybenzenesulfonic acid IUPAC Name: 5-(dibenzylsulfamoyl)-2-methoxybenzenesulfonic acid Traditional Name: 5-(dibenzylsulfamoyl)-2-methoxy-besylic acid Formula: C21H21NO6S2 MolecularWeight: 447.52454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C21H21NO6S2/c1-28-20-13-12-19(14-21(20)30(25,26)27)29(23,24)22(15-17-8-4-2-5-9-17)16-18-10-6-3-7-11-18/h2-14H,15-16H2,1H3,(H,25,26,27)