3-bromanyl-5-methoxy-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-phenylmethoxy-benzamide

Systemtic Name: 3-bromanyl-5-methoxy-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-3-bromo-5-methoxy-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzamide CAS Name: 3-bromo-5-methoxy-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-4-phenylmethoxybenzamide IUPAC Name: 3-bromo-5-methoxy-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-3-bromo-5-methoxy-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzamide Formula: C23H30BrN2O4+ MolecularWeight: 478.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)OC)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)OC)[NH+]3CCOCC3

InChI

InChI=1S/C23H29BrN2O4/c1-23(2,26-9-11-29-12-10-26)16-25-22(27)18-13-19(24)21(20(14-18)28-3)30-15-17-7-5-4-6-8-17/h4-8,13-14H,9-12,15-16H2,1-3H3,(H,25,27)/p+1