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

Systemtic Name: ethyl 2-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanylethanoyloxy]benzoate Openeye Name: ethyl 2-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanylacetyl]oxybenzoate CAS Name: 2-[2-[[2-nitro-4-(trifluoromethylsulfonyl)phenyl]thio]-1-oxoethoxy]benzoic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanylacetyl]oxybenzoate Traditional Name: 2-[2-[(2-nitro-4-triflyl-phenyl)thio]acetyl]oxybenzoic acid ethyl ester Formula: C18H14F3NO8S2 MolecularWeight: 493.43087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14F3NO8S2/c1-2-29-17(24)12-5-3-4-6-14(12)30-16(23)10-31-15-8-7-11(9-13(15)22(25)26)32(27,28)18(19,20)21/h3-9H,2,10H2,1H3