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

Systemtic Name: 2-[[4-[3-(butylsulfonylamino)-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[3-(butylsulfonylamino)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-[3-(butylsulfonylamino)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-[3-(butylsulfonylamino)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-[3-(butylsulfonylamino)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C20H24N2O7S MolecularWeight: 436.47876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O7S/c1-4-5-8-30(27,28)22-16-11-15(6-7-17(16)23)29-18-12(2)9-14(10-13(18)3)21-19(24)20(25)26/h6-7,9-11,22-23H,4-5,8H2,1-3H3,(H,21,24)(H,25,26)