2-(1,1-diphenylbutylcarbamoyloxy)ethyl-diethyl-azanium chloride

Systemtic Name: 2-(1,1-diphenylbutylcarbamoyloxy)ethyl-diethyl-azanium chloride Openeye Name: 2-(1,1-diphenylbutylcarbamoyloxy)ethyl-diethyl-ammonium chloride CAS Name: 2-[(1,1-diphenylbutylamino)-oxomethoxy]ethyl-diethylammonium chloride IUPAC Name: 2-(1,1-diphenylbutylcarbamoyloxy)ethyl-diethylazanium chloride Traditional Name: 2-(1,1-diphenylbutylcarbamoyloxy)ethyl-diethyl-ammonium chloride Formula: C23H33ClN2O2 MolecularWeight: 404.97332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)NC(=O)OCC[NH+](CC)CC.[Cl-]

Isomeric SMILES

CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)NC(=O)OCC[NH+](CC)CC.[Cl-]

InChI

InChI=1S/C23H32N2O2.ClH/c1-4-17-23(20-13-9-7-10-14-20,21-15-11-8-12-16-21)24-22(26)27-19-18-25(5-2)6-3;/h7-16H,4-6,17-19H2,1-3H3,(H,24,26);1H