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

Systemtic Name: 2-[[4-[3-(2-cyclobutylethanoyl)-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[3-(2-cyclobutylacetyl)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-[3-(2-cyclobutyl-1-oxoethyl)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-[3-(2-cyclobutylacetyl)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-[3-(2-cyclobutylacetyl)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)CC3CCC3)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)CC3CCC3)C)NC(=O)C(=O)O

InChI

InChI=1S/C22H23NO6/c1-12-8-15(23-21(26)22(27)28)9-13(2)20(12)29-16-6-7-18(24)17(11-16)19(25)10-14-4-3-5-14/h6-9,11,14,24H,3-5,10H2,1-2H3,(H,23,26)(H,27,28)