1-[(3-chlorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium

Systemtic Name: 1-[(3-chlorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Openeye Name: 1-[(3-chlorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium CAS Name: 1-[(3-chlorophenyl)methyl]-4-[[(2R)-2-pyrrolidin-1-iumyl]methyl]piperazin-1-ium IUPAC Name: 1-[(3-chlorophenyl)methyl]-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Traditional Name: 1-(3-chlorobenzyl)-4-[[(2R)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Formula: C16H26ClN3+2 MolecularWeight: 295.85074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)CN2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[C@@H]([NH2+]C1)CN2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H24ClN3/c17-15-4-1-3-14(11-15)12-19-7-9-20(10-8-19)13-16-5-2-6-18-16/h1,3-4,11,16,18H,2,5-10,12-13H2/p+2/t16-/m1/s1