ethyl 2-[2-[2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]-2-oxidanylidene-ethoxy]ethanoylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[2-[2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]-2-oxidanylidene-ethoxy]ethanoylsulfanyl]ethanoate Openeye Name: ethyl 2-[2-[2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]-2-oxo-ethoxy]acetyl]sulfanylacetate CAS Name: 2-[[2-[2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]-2-oxoethoxy]-1-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]-2-oxoethoxy]acetyl]sulfanylacetate Traditional Name: 2-[[2-[2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]-2-keto-ethoxy]acetyl]thio]acetic acid ethyl ester Formula: C21H17ClF3NO8S MolecularWeight: 535.87479

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClF3NO8S/c1-2-33-19(28)11-35-20(29)10-32-9-17(27)14-8-13(4-5-16(14)26(30)31)34-18-6-3-12(7-15(18)22)21(23,24)25/h3-8H,2,9-11H2,1H3