N'-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide

Systemtic Name: N'-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide Openeye Name: N'-[(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-N-(2-fluorophenyl)butanediamide CAS Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide IUPAC Name: N'-[(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-N-(2-fluorophenyl)butanediamide Traditional Name: N'-[(5-bromo-2-propargyloxy-benzylidene)amino]-N-(2-fluorophenyl)succinamide Formula: C20H17BrFN3O3 MolecularWeight: 446.269683

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1)Br)C=NNC(=O)CCC(=O)NC2=CC=CC=C2F

Isomeric SMILES

C#CCOC1=C(C=C(C=C1)Br)C=NNC(=O)CCC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C20H17BrFN3O3/c1-2-11-28-18-8-7-15(21)12-14(18)13-23-25-20(27)10-9-19(26)24-17-6-4-3-5-16(17)22/h1,3-8,12-13H,9-11H2,(H,24,26)(H,25,27)