methyl 4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoate

Systemtic Name: methyl 4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoate Openeye Name: methyl 4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoate CAS Name: 4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoate Traditional Name: 4-[2-(2-nitro-4-triflyl-phenoxy)ethoxy]benzoic acid methyl ester Formula: C17H14F3NO8S MolecularWeight: 449.35517

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14F3NO8S/c1-27-16(22)11-2-4-12(5-3-11)28-8-9-29-15-7-6-13(10-14(15)21(23)24)30(25,26)17(18,19)20/h2-7,10H,8-9H2,1H3