N'-[(3-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide

Systemtic Name: N'-[(3-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide Openeye Name: N'-[(3-bromo-5-ethoxy-4-isopropoxy-phenyl)methyleneamino]-N-(4-fluorophenyl)butanediamide CAS Name: N'-[(3-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide IUPAC Name: N'-[(3-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]-N-(4-fluorophenyl)butanediamide Traditional Name: N'-[(3-bromo-5-ethoxy-4-isopropoxy-benzylidene)amino]-N-(4-fluorophenyl)succinamide Formula: C22H25BrFN3O4 MolecularWeight: 494.354003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=C(C=C2)F)Br)OC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=C(C=C2)F)Br)OC(C)C

InChI

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