ethyl 2-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoyloxy]benzoate

Systemtic Name: ethyl 2-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoyloxy]benzoate Openeye Name: ethyl 2-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetyl]oxybenzoate CAS Name: 2-[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1-oxoethoxy]benzoic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetyl]oxybenzoate Traditional Name: 2-[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetyl]oxybenzoic acid ethyl ester Formula: C18H14F3NO6S MolecularWeight: 429.36707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1OC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1OC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H14F3NO6S/c1-2-27-17(24)12-5-3-4-6-14(12)28-16(23)10-29-15-8-7-11(18(19,20)21)9-13(15)22(25)26/h3-9H,2,10H2,1H3