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

Systemtic Name: N'-[(3-bromanyl-4-butoxy-5-methoxy-phenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide Openeye Name: N'-[(3-bromo-4-butoxy-5-methoxy-phenyl)methyleneamino]-N-(4-fluorophenyl)butanediamide CAS Name: N'-[(3-bromo-4-butoxy-5-methoxyphenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide IUPAC Name: N'-[(3-bromo-4-butoxy-5-methoxyphenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide Traditional Name: N'-[(3-bromo-4-butoxy-5-methoxy-benzylidene)amino]-N-(4-fluorophenyl)succinamide Formula: C22H25BrFN3O4 MolecularWeight: 494.354003

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H25BrFN3O4/c1-3-4-11-31-22-18(23)12-15(13-19(22)30-2)14-25-27-21(29)10-9-20(28)26-17-7-5-16(24)6-8-17/h5-8,12-14H,3-4,9-11H2,1-2H3,(H,26,28)(H,27,29)