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

Systemtic Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-piperidin-1-ium-1-yl-piperidine Openeye Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-4-piperidin-1-ium-1-yl-piperidine CAS Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-2-oxolanyl]methyl]-4-imidazolyl]methyl]-4-(1-piperidin-1-iumyl)piperidine IUPAC Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-piperidin-1-ium-1-ylpiperidine Traditional Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-4-piperidin-1-ium-1-yl-piperidine Formula: C23H39N4O3S+ MolecularWeight: 451.64576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CCN(CC2)CC3=CN=C(N3CC4CCCO4)S(=O)(=O)CC5CC5

Isomeric SMILES

C1CC[NH+](CC1)C2CCN(CC2)CC3=CN=C(N3C[C@H]4CCCO4)S(=O)(=O)CC5CC5

InChI

InChI=1S/C23H38N4O3S/c28-31(29,18-19-6-7-19)23-24-15-21(27(23)17-22-5-4-14-30-22)16-25-12-8-20(9-13-25)26-10-2-1-3-11-26/h15,19-20,22H,1-14,16-18H2/p+1/t22-/m1/s1