N-[[(3R)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methyl]ethanamide

Systemtic Name: N-[[(3R)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methyl]ethanamide Openeye Name: N-[[(3R)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methyl]acetamide CAS Name: N-[[(3R)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl]-3-piperidin-1-iumyl]methyl]acetamide IUPAC Name: N-[[(3R)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methyl]acetamide Traditional Name: N-[[(3R)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-3-yl]methyl]acetamide Formula: C21H37N4O3S+ MolecularWeight: 425.60848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCCC(C3)CNC(=O)C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCC[C@@H](C3)CNC(=O)C

InChI

InChI=1S/C21H36N4O3S/c1-3-4-11-25-20(13-23-21(25)29(27,28)16-18-7-5-8-18)15-24-10-6-9-19(14-24)12-22-17(2)26/h13,18-19H,3-12,14-16H2,1-2H3,(H,22,26)/p+1/t19-/m1/s1