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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)NS(=O)(=O)C(C)C)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)NS(=O)(=O)C(C)C)C)NC(=O)C(=O)O

InChI

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