4-[[5-methyl-2-[methylsulfonyl(propan-2-yl)amino]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[5-methyl-2-[methylsulfonyl(propan-2-yl)amino]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[isopropyl(methylsulfonyl)amino]-5-methyl-phenoxy]methyl]benzoic acid CAS Name: 4-[[5-methyl-2-[methylsulfonyl(propan-2-yl)amino]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[5-methyl-2-[methylsulfonyl(propan-2-yl)amino]phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[isopropyl(mesyl)amino]-5-methyl-phenoxy]methyl]benzoic acid Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C(C)C)S(=O)(=O)C)OCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N(C(C)C)S(=O)(=O)C)OCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H23NO5S/c1-13(2)20(26(4,23)24)17-10-5-14(3)11-18(17)25-12-15-6-8-16(9-7-15)19(21)22/h5-11,13H,12H2,1-4H3,(H,21,22)