N-[(E)-[3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-5-nitro-1-benzofuran-2-carboxamide

Systemtic Name: N-[(E)-[3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]-5-nitro-1-benzofuran-2-carboxamide Openeye Name: N-[(E)-[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyleneamino]-5-nitro-benzofuran-2-carboxamide CAS Name: N-[(E)-[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-5-nitro-2-benzofurancarboxamide IUPAC Name: N-[(E)-[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-5-nitro-1-benzofuran-2-carboxamide Traditional Name: N-[(E)-[3-bromo-4-(2-fluorobenzyl)oxy-5-methoxy-benzylidene]amino]-5-nitro-coumarilamide Formula: C24H17BrFN3O6 MolecularWeight: 542.310683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)C2=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])Br)OCC4=CC=CC=C4F

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])Br)OCC4=CC=CC=C4F

InChI

InChI=1S/C24H17BrFN3O6/c1-33-21-9-14(8-18(25)23(21)34-13-15-4-2-3-5-19(15)26)12-27-28-24(30)22-11-16-10-17(29(31)32)6-7-20(16)35-22/h2-12H,13H2,1H3,(H,28,30)/b27-12+