(2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]piperidine-1-sulfonic acid

Systemtic Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]piperidine-1-sulfonic acid Openeye Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]piperidine-1-sulfonic acid CAS Name: (2S)-2-[(3-butyl-1-imidazol-1-iumyl)methyl]-1-piperidinesulfonic acid IUPAC Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]piperidine-1-sulfonic acid Traditional Name: (2S)-2-[(3-butylimidazol-1-ium-1-yl)methyl]piperidine-1-sulfonic acid Formula: C13H24N3O3S+ MolecularWeight: 302.41296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CC2CCCCN2S(=O)(=O)O

Isomeric SMILES

CCCCN1C=C[N+](=C1)C[C@@H]2CCCCN2S(=O)(=O)O

InChI

InChI=1S/C13H23N3O3S/c1-2-3-7-14-9-10-15(12-14)11-13-6-4-5-8-16(13)20(17,18)19/h9-10,12-13H,2-8,11H2,1H3/p+1/t13-/m0/s1