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

Systemtic Name: N-[(E)-[2-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methylideneamino]pyridine-3-carboxamide Openeye Name: N-[(E)-[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyleneamino]pyridine-3-carboxamide CAS Name: N-[(E)-[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylideneamino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methylideneamino]pyridine-3-carboxamide Traditional Name: N-[(E)-[2-bromo-4-(4-fluorobenzyl)oxy-5-methoxy-benzylidene]amino]nicotinamide Formula: C21H17BrFN3O3 MolecularWeight: 458.280383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=NNC(=O)C2=CN=CC=C2)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=N/NC(=O)C2=CN=CC=C2)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H17BrFN3O3/c1-28-19-9-16(12-25-26-21(27)15-3-2-8-24-11-15)18(22)10-20(19)29-13-14-4-6-17(23)7-5-14/h2-12H,13H2,1H3,(H,26,27)/b25-12+