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

Systemtic Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine Openeye Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine CAS Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-2-piperidin-1-iumyl]pyridine IUPAC Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine Traditional Name: 2-[(2S)-1-[[2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine Formula: C19H29N4O3S+ MolecularWeight: 393.52356

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCCC2C3=CC=CC=N3

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCC[C@H]2C3=CC=CC=N3

InChI

InChI=1S/C19H28N4O3S/c1-3-27(24,25)19-21-14-16(23(19)12-13-26-2)15-22-11-7-5-9-18(22)17-8-4-6-10-20-17/h4,6,8,10,14,18H,3,5,7,9,11-13,15H2,1-2H3/p+1/t18-/m0/s1