2-ethanoylsulfanylethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]ethanoate

Systemtic Name: 2-ethanoylsulfanylethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]ethanoate Openeye Name: 2-acetylsulfanylethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]acetate CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]acetic acid 2-(acetylthio)ethyl ester IUPAC Name: 2-acetylsulfanylethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]acetate Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]acetic acid 2-(acetylthio)ethyl ester Formula: C19H15ClF3NO6S MolecularWeight: 477.83871

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)SCCOC(=O)CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClF3NO6S/c1-11(25)31-7-6-29-18(26)9-12-8-14(3-4-16(12)24(27)28)30-17-5-2-13(10-15(17)20)19(21,22)23/h2-5,8,10H,6-7,9H2,1H3