ethyl N-[4-[4-(2-diethylaminoethyl)piperazin-4-ium-1-yl]butyl]carbamate chloride

Systemtic Name: ethyl N-[4-[4-(2-diethylaminoethyl)piperazin-4-ium-1-yl]butyl]carbamate chloride Openeye Name: ethyl N-[4-[4-(2-diethylaminoethyl)piperazin-4-ium-1-yl]butyl]carbamate chloride CAS Name: N-[4-[4-(2-diethylaminoethyl)-1-piperazin-4-iumyl]butyl]carbamic acid ethyl ester chloride IUPAC Name: ethyl N-[4-[4-(2-diethylaminoethyl)piperazin-4-ium-1-yl]butyl]carbamate chloride Traditional Name: N-[4-[4-(2-diethylaminoethyl)piperazin-4-ium-1-yl]butyl]carbamic acid ethyl ester chloride Formula: C17H37ClN4O2 MolecularWeight: 364.95428

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[NH+]1CCN(CC1)CCCCNC(=O)OCC.[Cl-]

Isomeric SMILES

CCN(CC)CC[NH+]1CCN(CC1)CCCCNC(=O)OCC.[Cl-]

InChI

InChI=1S/C17H36N4O2.ClH/c1-4-19(5-2)11-12-21-15-13-20(14-16-21)10-8-7-9-18-17(22)23-6-3;/h4-16H2,1-3H3,(H,18,22);1H