N-(4-bromanyl-3-methyl-phenyl)-3-(2,6-dimethylmorpholin-4-ium-4-yl)propanamide chloride

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-(2,6-dimethylmorpholin-4-ium-4-yl)propanamide chloride Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-(2,6-dimethylmorpholin-4-ium-4-yl)propanamide chloride CAS Name: N-(4-bromo-3-methylphenyl)-3-(2,6-dimethyl-4-morpholin-4-iumyl)propanamide chloride IUPAC Name: N-(4-bromo-3-methylphenyl)-3-(2,6-dimethylmorpholin-4-ium-4-yl)propanamide chloride Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-(2,6-dimethylmorpholin-4-ium-4-yl)propionamide chloride Formula: C16H24BrClN2O2 MolecularWeight: 391.73096

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CCC(=O)NC2=CC(=C(C=C2)Br)C.[Cl-]

Isomeric SMILES

CC1C[NH+](CC(O1)C)CCC(=O)NC2=CC(=C(C=C2)Br)C.[Cl-]

InChI

InChI=1S/C16H23BrN2O2.ClH/c1-11-8-14(4-5-15(11)17)18-16(20)6-7-19-9-12(2)21-13(3)10-19;/h4-5,8,12-13H,6-7,9-10H2,1-3H3,(H,18,20);1H