N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-N-(phenylmethyl)benzamide bromide

Systemtic Name: N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-N-(phenylmethyl)benzamide bromide Openeye Name: N-benzyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]benzamide bromide CAS Name: N-[2-(4-methyl-4-morpholin-4-iumyl)ethyl]-N-(phenylmethyl)benzamide bromide IUPAC Name: N-benzyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]benzamide bromide Traditional Name: N-benzyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]benzamide bromide Formula: C21H27BrN2O2 MolecularWeight: 419.35528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCN(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C[N+]1(CCOCC1)CCN(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C21H27N2O2.BrH/c1-23(14-16-25-17-15-23)13-12-22(18-19-8-4-2-5-9-19)21(24)20-10-6-3-7-11-20;/h2-11H,12-18H2,1H3;1H/q+1;/p-1