N'-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide

Systemtic Name: N'-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide Openeye Name: N'-[(4-allyloxy-3-bromo-5-methoxy-phenyl)methyleneamino]-N-(2-fluorophenyl)butanediamide CAS Name: N'-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide IUPAC Name: N'-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide Traditional Name: N'-[(4-allyloxy-3-bromo-5-methoxy-benzylidene)amino]-N-(2-fluorophenyl)succinamide Formula: C21H21BrFN3O4 MolecularWeight: 478.311543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2F)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2F)Br)OCC=C

InChI

InChI=1S/C21H21BrFN3O4/c1-3-10-30-21-15(22)11-14(12-18(21)29-2)13-24-26-20(28)9-8-19(27)25-17-7-5-4-6-16(17)23/h3-7,11-13H,1,8-10H2,2H3,(H,25,27)(H,26,28)