3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propylazanium

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propylazanium Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propylammonium CAS Name: 3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]propylammonium IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propylazanium Traditional Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propylammonium Formula: C13H22ClN3+2 MolecularWeight: 255.78688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC[NH3+])C2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCC[NH3+])C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H20ClN3/c14-12-3-1-4-13(11-12)17-9-7-16(8-10-17)6-2-5-15/h1,3-4,11H,2,5-10,15H2/p+2