3-[2-chloranyl-3-(4-nitrophenoxy)-6-(trifluoromethyl)phenyl]carbonyloxypropanoic acid

Systemtic Name: 3-[2-chloranyl-3-(4-nitrophenoxy)-6-(trifluoromethyl)phenyl]carbonyloxypropanoic acid Openeye Name: 3-[2-chloro-3-(4-nitrophenoxy)-6-(trifluoromethyl)benzoyl]oxypropanoic acid CAS Name: 3-[[2-chloro-3-(4-nitrophenoxy)-6-(trifluoromethyl)phenyl]-oxomethoxy]propanoic acid IUPAC Name: 3-[2-chloro-3-(4-nitrophenoxy)-6-(trifluoromethyl)benzoyl]oxypropanoic acid Traditional Name: 3-[2-chloro-3-(4-nitrophenoxy)-6-(trifluoromethyl)benzoyl]oxypropionic acid Formula: C17H11ClF3NO7 MolecularWeight: 433.71995

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C(=C(C=C2)C(F)(F)F)C(=O)OCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C(=C(C=C2)C(F)(F)F)C(=O)OCCC(=O)O)Cl

InChI

InChI=1S/C17H11ClF3NO7/c18-15-12(29-10-3-1-9(2-4-10)22(26)27)6-5-11(17(19,20)21)14(15)16(25)28-8-7-13(23)24/h1-6H,7-8H2,(H,23,24)