ethyl 5-[4-[bis(fluoranyl)methyl]-2,6-dinitro-phenoxy]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[4-[bis(fluoranyl)methyl]-2,6-dinitro-phenoxy]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[4-(difluoromethyl)-2,6-dinitro-phenoxy]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[4-(difluoromethyl)-2,6-dinitrophenoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(difluoromethyl)-2,6-dinitrophenoxy]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[4-(difluoromethyl)-2,6-dinitro-phenoxy]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C24H16F2N2O8 MolecularWeight: 498.389246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)F)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC3=C(C=C(C=C3[N+](=O)[O-])C(F)F)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H16F2N2O8/c1-2-34-24(29)20-16-12-15(8-9-19(16)36-21(20)13-6-4-3-5-7-13)35-22-17(27(30)31)10-14(23(25)26)11-18(22)28(32)33/h3-12,23H,2H2,1H3