2-[[1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-4-yl]oxymethyl]pyridine

Systemtic Name: 2-[[1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-4-yl]oxymethyl]pyridine Openeye Name: 2-[[1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-4-yl]oxymethyl]pyridine CAS Name: 2-[[1-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-4-piperidin-1-iumyl]oxymethyl]pyridine IUPAC Name: 2-[[1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-4-yl]oxymethyl]pyridine Traditional Name: 2-[[1-[[2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-4-yl]oxymethyl]pyridine Formula: C20H31N4O4S+ MolecularWeight: 423.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCC(CC2)OCC3=CC=CC=N3

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCC(CC2)OCC3=CC=CC=N3

InChI

InChI=1S/C20H30N4O4S/c1-3-29(25,26)20-22-14-18(24(20)12-13-27-2)15-23-10-7-19(8-11-23)28-16-17-6-4-5-9-21-17/h4-6,9,14,19H,3,7-8,10-13,15-16H2,1-2H3/p+1