N'-[(3-bromanyl-4-butoxy-5-ethoxy-phenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide

Systemtic Name: N'-[(3-bromanyl-4-butoxy-5-ethoxy-phenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide Openeye Name: N'-[(3-bromo-4-butoxy-5-ethoxy-phenyl)methyleneamino]-N-(4-fluorophenyl)butanediamide CAS Name: N'-[(3-bromo-4-butoxy-5-ethoxyphenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide IUPAC Name: N'-[(3-bromo-4-butoxy-5-ethoxyphenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide Traditional Name: N'-[(3-bromo-4-butoxy-5-ethoxy-benzylidene)amino]-N-(4-fluorophenyl)succinamide Formula: C23H27BrFN3O4 MolecularWeight: 508.380583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Br)C=NNC(=O)CCC(=O)NC2=CC=C(C=C2)F)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Br)C=NNC(=O)CCC(=O)NC2=CC=C(C=C2)F)OCC

InChI

InChI=1S/C23H27BrFN3O4/c1-3-5-12-32-23-19(24)13-16(14-20(23)31-4-2)15-26-28-22(30)11-10-21(29)27-18-8-6-17(25)7-9-18/h6-9,13-15H,3-5,10-12H2,1-2H3,(H,27,29)(H,28,30)