2-[4-[2-[(3,5-dimethylphenyl)amino]-1-oxidanyl-2-oxidanylidene-ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[(3,5-dimethylphenyl)amino]-1-oxidanyl-2-oxidanylidene-ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-(3,5-dimethylanilino)-1-hydroxy-2-oxo-ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-(3,5-dimethylanilino)-1-hydroxy-2-oxoethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-(3,5-dimethylanilino)-1-hydroxy-2-oxoethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-(3,5-dimethylanilino)-1-hydroxy-2-keto-ethyl]phenoxy]-2-methyl-propionic acid Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(C2=CC=C(C=C2)OC(C)(C)C(=O)O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C(C2=CC=C(C=C2)OC(C)(C)C(=O)O)O)C

InChI

InChI=1S/C20H23NO5/c1-12-9-13(2)11-15(10-12)21-18(23)17(22)14-5-7-16(8-6-14)26-20(3,4)19(24)25/h5-11,17,22H,1-4H3,(H,21,23)(H,24,25)