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

Systemtic Name: 5-bromanyl-N-[(E)-[4-(2,4-dinitrophenoxy)-3-methoxy-phenyl]methylideneamino]-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[(E)-[4-(2,4-dinitrophenoxy)-3-methoxy-phenyl]methyleneamino]benzofuran-2-carboxamide CAS Name: 5-bromo-N-[(E)-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylideneamino]-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[(E)-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylideneamino]-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[(E)-[4-(2,4-dinitrophenoxy)-3-methoxy-benzylidene]amino]coumarilamide Formula: C23H15BrN4O8 MolecularWeight: 555.2912

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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)Br)OC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC3=C(O2)C=CC(=C3)Br)OC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H15BrN4O8/c1-34-21-8-13(12-25-26-23(29)22-10-14-9-15(24)3-6-18(14)35-22)2-5-20(21)36-19-7-4-16(27(30)31)11-17(19)28(32)33/h2-12H,1H3,(H,26,29)/b25-12+