1,3-bis[[(2S)-pyrrolidin-2-yl]methyl]imidazol-1-ium chloride

Systemtic Name: 1,3-bis[[(2S)-pyrrolidin-2-yl]methyl]imidazol-1-ium chloride Openeye Name: 1,3-bis[[(2S)-pyrrolidin-2-yl]methyl]imidazol-1-ium chloride CAS Name: 1,3-bis[[(2S)-2-pyrrolidinyl]methyl]imidazol-1-ium chloride IUPAC Name: 1,3-bis[[(2S)-pyrrolidin-2-yl]methyl]imidazol-1-ium chloride Traditional Name: 1,3-bis[[(2S)-pyrrolidin-2-yl]methyl]imidazol-1-ium chloride Formula: C13H23ClN4 MolecularWeight: 270.80152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)CN2C=C[N+](=C2)CC3CCCN3.[Cl-]

Isomeric SMILES

C1C[C@H](NC1)CN2C=C[N+](=C2)C[C@@H]3CCCN3.[Cl-]

InChI

InChI=1S/C13H23N4.ClH/c1-3-12(14-5-1)9-16-7-8-17(11-16)10-13-4-2-6-15-13;/h7-8,11-15H,1-6,9-10H2;1H/q+1;/p-1/t12-,13-;/m0./s1