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

Systemtic Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium Openeye Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium CAS Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-2-oxolanyl]methyl]-4-imidazolyl]methyl]-4-methoxypiperidin-1-ium IUPAC Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-oxolan-2-yl]methyl]imidazol-4-yl]methyl]-4-methoxypiperidin-1-ium Traditional Name: 1-[[2-(cyclopropylmethylsulfonyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-4-yl]methyl]-4-methoxy-piperidin-1-ium Formula: C19H32N3O4S+ MolecularWeight: 398.54008

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC[NH+](CC1)CC2=CN=C(N2CC3CCCO3)S(=O)(=O)CC4CC4

Isomeric SMILES

COC1CC[NH+](CC1)CC2=CN=C(N2C[C@H]3CCCO3)S(=O)(=O)CC4CC4

InChI

InChI=1S/C19H31N3O4S/c1-25-17-6-8-21(9-7-17)12-16-11-20-19(27(23,24)14-15-4-5-15)22(16)13-18-3-2-10-26-18/h11,15,17-18H,2-10,12-14H2,1H3/p+1/t18-/m1/s1