4-[[4-chloranyl-2-[ethyl(phenylsulfonyl)amino]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-chloranyl-2-[ethyl(phenylsulfonyl)amino]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[benzenesulfonyl(ethyl)amino]-4-chloro-phenoxy]methyl]benzoic acid CAS Name: 4-[[2-[benzenesulfonyl(ethyl)amino]-4-chlorophenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-[benzenesulfonyl(ethyl)amino]-4-chlorophenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[besyl(ethyl)amino]-4-chloro-phenoxy]methyl]benzoic acid Formula: C22H20ClNO5S MolecularWeight: 445.9159

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(C1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20ClNO5S/c1-2-24(30(27,28)19-6-4-3-5-7-19)20-14-18(23)12-13-21(20)29-15-16-8-10-17(11-9-16)22(25)26/h3-14H,2,15H2,1H3,(H,25,26)