6-(3-bromanylphenoxy)-N-[[4-(dimethylaminomethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-bromanylphenoxy)-N-[[4-(dimethylaminomethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 6-(3-bromophenoxy)-N-[[4-(dimethylaminomethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 6-(3-bromophenoxy)-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-bromophenoxy)-N-[[4-(dimethylaminomethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 6-(3-bromophenoxy)-N-[4-(dimethylaminomethyl)benzyl]nicotinamide Formula: C22H22BrN3O2 MolecularWeight: 440.33298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)CNC(=O)C2=CN=C(C=C2)OC3=CC(=CC=C3)Br

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)CNC(=O)C2=CN=C(C=C2)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H22BrN3O2/c1-26(2)15-17-8-6-16(7-9-17)13-25-22(27)18-10-11-21(24-14-18)28-20-5-3-4-19(23)12-20/h3-12,14H,13,15H2,1-2H3,(H,25,27)