[3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-[[(2R)-5-oxidanylidenepyrrolidin-2-yl]methyl]-propan-2-yl-azanium

Systemtic Name: [3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-[[(2R)-5-oxidanylidenepyrrolidin-2-yl]methyl]-propan-2-yl-azanium Openeye Name: (3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl-isopropyl-[[(2R)-5-oxopyrrolidin-2-yl]methyl]ammonium CAS Name: [3-butyl-2-(4-methylpentylsulfonyl)-4-imidazolyl]methyl-[[(2R)-5-oxo-2-pyrrolidinyl]methyl]-propan-2-ylammonium IUPAC Name: [3-butyl-2-(4-methylpentylsulfonyl)imidazol-4-yl]methyl-[[(2R)-5-oxopyrrolidin-2-yl]methyl]-propan-2-ylazanium Traditional Name: (3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl-isopropyl-[[(2R)-5-ketopyrrolidin-2-yl]methyl]ammonium Formula: C22H41N4O3S+ MolecularWeight: 441.65094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CCCC(C)C)C[NH+](CC2CCC(=O)N2)C(C)C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CCCC(C)C)C[NH+](C[C@H]2CCC(=O)N2)C(C)C

InChI

InChI=1S/C22H40N4O3S/c1-6-7-12-26-20(14-23-22(26)30(28,29)13-8-9-17(2)3)16-25(18(4)5)15-19-10-11-21(27)24-19/h14,17-19H,6-13,15-16H2,1-5H3,(H,24,27)/p+1/t19-/m1/s1