2-(3-chloranyl-2-oxidanyl-phenyl)-2-methyl-3-(1,3-oxazol-4-yl)-4-oxidanylidene-3-(3-propan-2-ylphenoxy)hexanoic acid

Systemtic Name: 2-(3-chloranyl-2-oxidanyl-phenyl)-2-methyl-3-(1,3-oxazol-4-yl)-4-oxidanylidene-3-(3-propan-2-ylphenoxy)hexanoic acid Openeye Name: 2-(3-chloro-2-hydroxy-phenyl)-3-(3-isopropylphenoxy)-2-methyl-3-oxazol-4-yl-4-oxo-hexanoic acid CAS Name: 2-(3-chloro-2-hydroxyphenyl)-2-methyl-3-(4-oxazolyl)-4-oxo-3-(3-propan-2-ylphenoxy)hexanoic acid IUPAC Name: 2-(3-chloro-2-hydroxyphenyl)-2-methyl-3-(1,3-oxazol-4-yl)-4-oxo-3-(3-propan-2-ylphenoxy)hexanoic acid Traditional Name: 2-(3-chloro-2-hydroxy-phenyl)-3-(3-isopropylphenoxy)-4-keto-2-methyl-3-oxazol-4-yl-hexanoic acid Formula: C25H26ClNO6 MolecularWeight: 471.93004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=COC=N1)(C(C)(C2=C(C(=CC=C2)Cl)O)C(=O)O)OC3=CC=CC(=C3)C(C)C

Isomeric SMILES

CCC(=O)C(C1=COC=N1)(C(C)(C2=C(C(=CC=C2)Cl)O)C(=O)O)OC3=CC=CC(=C3)C(C)C

InChI

InChI=1S/C25H26ClNO6/c1-5-21(28)25(20-13-32-14-27-20,33-17-9-6-8-16(12-17)15(2)3)24(4,23(30)31)18-10-7-11-19(26)22(18)29/h6-15,29H,5H2,1-4H3,(H,30,31)