N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]-N-(phenylmethyl)benzamide bromide

Systemtic Name: N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]-N-(phenylmethyl)benzamide bromide Openeye Name: N-benzyl-N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]benzamide bromide CAS Name: N-[3-(4-methyl-4-morpholin-4-iumyl)propyl]-N-(phenylmethyl)benzamide bromide IUPAC Name: N-benzyl-N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]benzamide bromide Traditional Name: N-benzyl-N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]benzamide bromide Formula: C22H29BrN2O2 MolecularWeight: 433.38186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N2O2.BrH/c1-24(15-17-26-18-16-24)14-8-13-23(19-20-9-4-2-5-10-20)22(25)21-11-6-3-7-12-21;/h2-7,9-12H,8,13-19H2,1H3;1H/q+1;/p-1