2-[[3,5-dimethyl-4-[4-oxidanyl-3-(propylsulfonylamino)phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[3,5-dimethyl-4-[4-oxidanyl-3-(propylsulfonylamino)phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[4-hydroxy-3-(propylsulfonylamino)phenoxy]-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-[4-hydroxy-3-(propylsulfonylamino)phenoxy]-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-[4-hydroxy-3-(propylsulfonylamino)phenoxy]-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-[4-hydroxy-3-(propylsulfonylamino)phenoxy]-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=C(C=CC(=C1)OC2=C(C=C(C=C2C)NC(=O)C(=O)O)C)O

Isomeric SMILES

CCCS(=O)(=O)NC1=C(C=CC(=C1)OC2=C(C=C(C=C2C)NC(=O)C(=O)O)C)O

InChI

InChI=1S/C19H22N2O7S/c1-4-7-29(26,27)21-15-10-14(5-6-16(15)22)28-17-11(2)8-13(9-12(17)3)20-18(23)19(24)25/h5-6,8-10,21-22H,4,7H2,1-3H3,(H,20,23)(H,24,25)