N'-[(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide

Systemtic Name: N'-[(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide Openeye Name: N'-[(3-bromo-4-isopropoxy-5-methoxy-phenyl)methyleneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide CAS Name: N'-[(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide IUPAC Name: N'-[(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]propanediamide Traditional Name: N'-[(3-bromo-4-isopropoxy-5-methoxy-benzylidene)amino]-N-[3-(trifluoromethyl)phenyl]malonamide Formula: C21H21BrF3N3O4 MolecularWeight: 516.30835

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Br)C=NNC(=O)CC(=O)NC2=CC=CC(=C2)C(F)(F)F)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Br)C=NNC(=O)CC(=O)NC2=CC=CC(=C2)C(F)(F)F)OC

InChI

InChI=1S/C21H21BrF3N3O4/c1-12(2)32-20-16(22)7-13(8-17(20)31-3)11-26-28-19(30)10-18(29)27-15-6-4-5-14(9-15)21(23,24)25/h4-9,11-12H,10H2,1-3H3,(H,27,29)(H,28,30)