4-[[5-chloranyl-2-[cyclopropylmethyl(phenylsulfonyl)amino]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[5-chloranyl-2-[cyclopropylmethyl(phenylsulfonyl)amino]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[benzenesulfonyl(cyclopropylmethyl)amino]-5-chloro-phenoxy]methyl]benzoic acid CAS Name: 4-[[2-[benzenesulfonyl(cyclopropylmethyl)amino]-5-chlorophenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-[benzenesulfonyl(cyclopropylmethyl)amino]-5-chlorophenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[besyl(cyclopropylmethyl)amino]-5-chloro-phenoxy]methyl]benzoic acid Formula: C24H22ClNO5S MolecularWeight: 471.95318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(C2=C(C=C(C=C2)Cl)OCC3=CC=C(C=C3)C(=O)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC1CN(C2=C(C=C(C=C2)Cl)OCC3=CC=C(C=C3)C(=O)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22ClNO5S/c25-20-12-13-22(23(14-20)31-16-18-8-10-19(11-9-18)24(27)28)26(15-17-6-7-17)32(29,30)21-4-2-1-3-5-21/h1-5,8-14,17H,6-7,15-16H2,(H,27,28)