4-[3-[5-chloranyl-2-(phenylsulfonylamino)phenoxy]propyl]benzoic acid

Systemtic Name: 4-[3-[5-chloranyl-2-(phenylsulfonylamino)phenoxy]propyl]benzoic acid Openeye Name: 4-[3-[2-(benzenesulfonamido)-5-chloro-phenoxy]propyl]benzoic acid CAS Name: 4-[3-[2-(benzenesulfonamido)-5-chlorophenoxy]propyl]benzoic acid IUPAC Name: 4-[3-[2-(benzenesulfonamido)-5-chlorophenoxy]propyl]benzoic acid Traditional Name: 4-[3-[2-(benzenesulfonamido)-5-chloro-phenoxy]propyl]benzoic acid Formula: C22H20ClNO5S MolecularWeight: 445.9159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)OCCCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)OCCCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H20ClNO5S/c23-18-12-13-20(24-30(27,28)19-6-2-1-3-7-19)21(15-18)29-14-4-5-16-8-10-17(11-9-16)22(25)26/h1-3,6-13,15,24H,4-5,14H2,(H,25,26)