1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium

Systemtic Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium Openeye Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium CAS Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-2-oxolanyl]methyl]-4-imidazolyl]methyl]-4-(1-pyrrolidin-1-iumyl)piperidin-1-ium IUPAC Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-pyrrolidin-1-ium-1-ylpiperidin-1-ium Traditional Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium Formula: C22H38N4O3S+2 MolecularWeight: 438.62712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CC[NH+](CC2)CC3=CN=C(N3CC4CCCO4)S(=O)(=O)CC5CC5

Isomeric SMILES

C1CC[NH+](C1)C2CC[NH+](CC2)CC3=CN=C(N3C[C@H]4CCCO4)S(=O)(=O)CC5CC5

InChI

InChI=1S/C22H36N4O3S/c27-30(28,17-18-5-6-18)22-23-14-20(26(22)16-21-4-3-13-29-21)15-24-11-7-19(8-12-24)25-9-1-2-10-25/h14,18-19,21H,1-13,15-17H2/p+2/t21-/m1/s1