2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-N,N'-bis(phenylmethyl)propanediamide

Systemtic Name: 2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-N,N'-bis(phenylmethyl)propanediamide Openeye Name: N,N'-dibenzyl-2-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]propanediamide CAS Name: 2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-N,N'-bis(phenylmethyl)propanediamide IUPAC Name: N,N'-dibenzyl-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]propanediamide Traditional Name: N,N'-dibenzyl-2-(3-bromo-4-hydroxy-5-methoxy-benzylidene)malonamide Formula: C25H23BrN2O4 MolecularWeight: 495.36512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C(=O)NCC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C(=O)NCC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)Br)O

InChI

InChI=1S/C25H23BrN2O4/c1-32-22-14-19(13-21(26)23(22)29)12-20(24(30)27-15-17-8-4-2-5-9-17)25(31)28-16-18-10-6-3-7-11-18/h2-14,29H,15-16H2,1H3,(H,27,30)(H,28,31)