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

Systemtic Name: 2-[[3-chloranyl-4-[3-(2-cyclobutylethanoyl)-4-oxidanyl-phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3-chloro-4-[3-(2-cyclobutylacetyl)-4-hydroxy-phenoxy]anilino]-2-oxo-acetic acid CAS Name: 2-[3-chloro-4-[3-(2-cyclobutyl-1-oxoethyl)-4-hydroxyphenoxy]anilino]-2-oxoacetic acid IUPAC Name: 2-[3-chloro-4-[3-(2-cyclobutylacetyl)-4-hydroxyphenoxy]anilino]-2-oxoacetic acid Traditional Name: 2-[3-chloro-4-[3-(2-cyclobutylacetyl)-4-hydroxy-phenoxy]anilino]-2-keto-acetic acid Formula: C20H18ClNO6 MolecularWeight: 403.81302

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)NC(=O)C(=O)O)Cl)O

Isomeric SMILES

C1CC(C1)CC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)NC(=O)C(=O)O)Cl)O

InChI

InChI=1S/C20H18ClNO6/c21-15-9-12(22-19(25)20(26)27)4-7-18(15)28-13-5-6-16(23)14(10-13)17(24)8-11-2-1-3-11/h4-7,9-11,23H,1-3,8H2,(H,22,25)(H,26,27)