3-bromanyl-4-methoxy-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-bromo-4-methoxy-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-bromo-4-methoxy-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-bromo-4-methoxy-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-bromo-4-methoxy-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]benzamide Formula: C20H24BrN2O3+ MolecularWeight: 420.32016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3)Br

InChI

InChI=1S/C20H23BrN2O3/c1-25-19-7-6-15(12-18(19)21)20(24)22-13-16-4-2-3-5-17(16)14-23-8-10-26-11-9-23/h2-7,12H,8-11,13-14H2,1H3,(H,22,24)/p+1