3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propyl-diethyl-azanium

Systemtic Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propyl-diethyl-azanium Openeye Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propyl-diethyl-ammonium CAS Name: 3-[4-(4-chlorophenyl)-1-piperazin-1-iumyl]propyl-diethylammonium IUPAC Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propyl-diethylazanium Traditional Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]propyl-diethyl-ammonium Formula: C17H30ClN3+2 MolecularWeight: 311.8932

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH+]1CCN(CC1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC[NH+](CC)CCC[NH+]1CCN(CC1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H28ClN3/c1-3-19(4-2)10-5-11-20-12-14-21(15-13-20)17-8-6-16(18)7-9-17/h6-9H,3-5,10-15H2,1-2H3/p+2