3-[(2S)-1-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-2-yl]propan-1-ol

Systemtic Name: 3-[(2S)-1-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-2-yl]propan-1-ol Openeye Name: 3-[(2S)-1-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-2-yl]propan-1-ol CAS Name: 3-[(2S)-1-[(3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl]-2-piperidin-1-iumyl]-1-propanol IUPAC Name: 3-[(2S)-1-[(3-butyl-2-ethylsulfonylimidazol-4-yl)methyl]piperidin-1-ium-2-yl]propan-1-ol Traditional Name: 3-[(2S)-1-[(3-butyl-2-esyl-imidazol-4-yl)methyl]piperidin-1-ium-2-yl]propan-1-ol Formula: C18H34N3O3S+ MolecularWeight: 372.54586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+]2CCCCC2CCCO

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+]2CCCC[C@H]2CCCO

InChI

InChI=1S/C18H33N3O3S/c1-3-5-12-21-17(14-19-18(21)25(23,24)4-2)15-20-11-7-6-9-16(20)10-8-13-22/h14,16,22H,3-13,15H2,1-2H3/p+1/t16-/m0/s1