3-[(2-acetamidophenyl)sulfamoyl]-4-phenoxy-5-[(phenylmethyl)amino]benzoic acid

Systemtic Name: 3-[(2-acetamidophenyl)sulfamoyl]-4-phenoxy-5-[(phenylmethyl)amino]benzoic acid Openeye Name: 3-[(2-acetamidophenyl)sulfamoyl]-5-(benzylamino)-4-phenoxy-benzoic acid CAS Name: 3-[(2-acetamidophenyl)sulfamoyl]-4-phenoxy-5-[(phenylmethyl)amino]benzoic acid IUPAC Name: 3-[(2-acetamidophenyl)sulfamoyl]-5-(benzylamino)-4-phenoxybenzoic acid Traditional Name: 3-[(2-acetamidophenyl)sulfamoyl]-5-(benzylamino)-4-phenoxy-benzoic acid Formula: C28H25N3O6S MolecularWeight: 531.5796

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1NS(=O)(=O)C2=CC(=CC(=C2OC3=CC=CC=C3)NCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC=C1NS(=O)(=O)C2=CC(=CC(=C2OC3=CC=CC=C3)NCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H25N3O6S/c1-19(32)30-23-14-8-9-15-24(23)31-38(35,36)26-17-21(28(33)34)16-25(29-18-20-10-4-2-5-11-20)27(26)37-22-12-6-3-7-13-22/h2-17,29,31H,18H2,1H3,(H,30,32)(H,33,34)