4-[2-(methylsulfonylamino)-6-phenylmethoxy-phenyl]carbonyl-3,5-bis(phenylmethoxy)benzoic acid

Systemtic Name: 4-[2-(methylsulfonylamino)-6-phenylmethoxy-phenyl]carbonyl-3,5-bis(phenylmethoxy)benzoic acid Openeye Name: 3,5-dibenzyloxy-4-[2-benzyloxy-6-(methanesulfonamido)benzoyl]benzoic acid CAS Name: 4-[[2-(methanesulfonamido)-6-phenylmethoxyphenyl]-oxomethyl]-3,5-bis(phenylmethoxy)benzoic acid IUPAC Name: 4-[2-(methanesulfonamido)-6-phenylmethoxybenzoyl]-3,5-bis(phenylmethoxy)benzoic acid Traditional Name: 3,5-dibenzoxy-4-[2-benzoxy-6-(methanesulfonamido)benzoyl]benzoic acid Formula: C36H31NO8S MolecularWeight: 637.69824

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C(=CC=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3OCC4=CC=CC=C4)C(=O)O)OCC5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)NC1=C(C(=CC=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3OCC4=CC=CC=C4)C(=O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C36H31NO8S/c1-46(41,42)37-29-18-11-19-30(43-22-25-12-5-2-6-13-25)33(29)35(38)34-31(44-23-26-14-7-3-8-15-26)20-28(36(39)40)21-32(34)45-24-27-16-9-4-10-17-27/h2-21,37H,22-24H2,1H3,(H,39,40)