(2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]pyrrolidine-1-sulfonate

Systemtic Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]pyrrolidine-1-sulfonate Openeye Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]pyrrolidine-1-sulfonate CAS Name: (2S)-2-[(3-butyl-1-imidazol-1-iumyl)methyl]-1-pyrrolidinesulfonate IUPAC Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]pyrrolidine-1-sulfonate Traditional Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]pyrrolidine-1-sulfonate Formula: C12H21N3O3S MolecularWeight: 287.37844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CC2CCCN2S(=O)(=O)[O-]

Isomeric SMILES

CCCCN1C=C[N+](=C1)C[C@@H]2CCCN2S(=O)(=O)[O-]

InChI

InChI=1S/C12H21N3O3S/c1-2-3-6-13-8-9-14(11-13)10-12-5-4-7-15(12)19(16,17)18/h8-9,11-12H,2-7,10H2,1H3/t12-/m0/s1