3-bromanyl-2,5-dimethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-bromanyl-2,5-dimethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-bromo-2,5-dimethoxy-N-[[4-(morpholinomethyl)phenyl]methyl]benzamide CAS Name: 3-bromo-2,5-dimethoxy-N-[[4-(4-morpholinylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-bromo-2,5-dimethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-bromo-2,5-dimethoxy-N-[4-(morpholinomethyl)benzyl]benzamide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCOCC3)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCOCC3)OC)Br

InChI

InChI=1S/C21H25BrN2O4/c1-26-17-11-18(20(27-2)19(22)12-17)21(25)23-13-15-3-5-16(6-4-15)14-24-7-9-28-10-8-24/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,23,25)