4-(4-phenylmethoxyphenoxy)-3-[(phenylmethyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(4-phenylmethoxyphenoxy)-3-[(phenylmethyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 3-(benzylamino)-4-(4-benzyloxyphenoxy)-5-sulfamoyl-benzoic acid CAS Name: 4-(4-phenylmethoxyphenoxy)-3-[(phenylmethyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 3-(benzylamino)-4-(4-phenylmethoxyphenoxy)-5-sulfamoylbenzoic acid Traditional Name: 4-(4-benzoxyphenoxy)-3-(benzylamino)-5-sulfamoyl-benzoic acid Formula: C27H24N2O6S MolecularWeight: 504.55426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O6S/c28-36(32,33)25-16-21(27(30)31)15-24(29-17-19-7-3-1-4-8-19)26(25)35-23-13-11-22(12-14-23)34-18-20-9-5-2-6-10-20/h1-16,29H,17-18H2,(H,30,31)(H2,28,32,33)