4-[[(3R)-1-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]morpholine

Systemtic Name: 4-[[(3R)-1-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]morpholine Openeye Name: 4-[[(3R)-1-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]morpholine CAS Name: 4-[[(3R)-1-[(3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl]-3-piperidin-1-iumyl]methyl]morpholine IUPAC Name: 4-[[(3R)-1-[(3-butyl-2-ethylsulfonylimidazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]morpholine Traditional Name: 4-[[(3R)-1-[(3-butyl-2-esyl-imidazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]morpholine Formula: C20H37N4O3S+ MolecularWeight: 413.59778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+]2CCCC(C2)CN3CCOCC3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+]2CCC[C@@H](C2)CN3CCOCC3

InChI

InChI=1S/C20H36N4O3S/c1-3-5-9-24-19(14-21-20(24)28(25,26)4-2)17-23-8-6-7-18(16-23)15-22-10-12-27-13-11-22/h14,18H,3-13,15-17H2,1-2H3/p+1/t18-/m1/s1