diethyl 2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]-5-oxidanyl-benzene-1,4-dicarboxylate

Systemtic Name: diethyl 2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]-5-oxidanyl-benzene-1,4-dicarboxylate Openeye Name: diethyl 2-hydroxy-5-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzene-1,4-dicarboxylate CAS Name: 2-hydroxy-5-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-hydroxy-5-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzene-1,4-dicarboxylate Traditional Name: 2-hydroxy-5-(2-nitro-4-triflyl-phenoxy)benzene-1,4-dicarboxylic acid diethyl ester Formula: C19H16F3NO10S MolecularWeight: 507.39125

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C(=O)OCC)O

InChI

InChI=1S/C19H16F3NO10S/c1-3-31-17(25)11-9-16(12(8-14(11)24)18(26)32-4-2)33-15-6-5-10(7-13(15)23(27)28)34(29,30)19(20,21)22/h5-9,24H,3-4H2,1-2H3