[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl-methyl-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C21H40N4O2S+2 MolecularWeight: 412.6329

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+](C)CCC[NH+]3CCCC3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+](C)CCC[NH+]3CCCC3

InChI

InChI=1S/C21H38N4O2S/c1-3-4-15-25-20(17-23(2)11-8-14-24-12-5-6-13-24)16-22-21(25)28(26,27)18-19-9-7-10-19/h16,19H,3-15,17-18H2,1-2H3/p+2