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

Systemtic Name: N'-[(3-bromanyl-4-propan-2-yloxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Openeye Name: N'-[(3-bromo-4-isopropoxy-phenyl)methyleneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide CAS Name: N'-[(3-bromo-4-propan-2-yloxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide IUPAC Name: N'-[(3-bromo-4-propan-2-yloxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]butanediamide Traditional Name: N'-[(3-bromo-4-isopropoxy-benzylidene)amino]-N-[3-(trifluoromethyl)phenyl]succinamide Formula: C21H21BrF3N3O3 MolecularWeight: 500.30895

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)Br

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C=NNC(=O)CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)Br

InChI

InChI=1S/C21H21BrF3N3O3/c1-13(2)31-18-7-6-14(10-17(18)22)12-26-28-20(30)9-8-19(29)27-16-5-3-4-15(11-16)21(23,24)25/h3-7,10-13H,8-9H2,1-2H3,(H,27,29)(H,28,30)