(2S)-1-(3-butylimidazol-1-ium-1-yl)-N,4-dimethyl-pentan-2-amine chloride

Systemtic Name: (2S)-1-(3-butylimidazol-1-ium-1-yl)-N,4-dimethyl-pentan-2-amine chloride Openeye Name: (2S)-1-(3-butylimidazol-1-ium-1-yl)-N,4-dimethyl-pentan-2-amine chloride CAS Name: (2S)-1-(3-butyl-1-imidazol-1-iumyl)-N,4-dimethyl-2-pentanamine chloride IUPAC Name: (2S)-1-(3-butylimidazol-1-ium-1-yl)-N,4-dimethylpentan-2-amine chloride Traditional Name: [(1S)-1-[(3-butylimidazol-1-ium-1-yl)methyl]-3-methyl-butyl]-methyl-amine chloride Formula: C14H28ClN3 MolecularWeight: 273.84522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CC(CC(C)C)NC.[Cl-]

Isomeric SMILES

CCCCN1C=C[N+](=C1)C[C@H](CC(C)C)NC.[Cl-]

InChI

InChI=1S/C14H28N3.ClH/c1-5-6-7-16-8-9-17(12-16)11-14(15-4)10-13(2)3;/h8-9,12-15H,5-7,10-11H2,1-4H3;1H/q+1;/p-1/t14-;/m0./s1