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

Systemtic Name: (3S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-(methoxymethyl)piperidin-1-ium Openeye Name: (3S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-(methoxymethyl)piperidin-1-ium CAS Name: (3S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-3-(methoxymethyl)piperidin-1-ium IUPAC Name: (3S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-(methoxymethyl)piperidin-1-ium Traditional Name: (3S)-1-[[2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-(methoxymethyl)piperidin-1-ium Formula: C16H30N3O4S+ MolecularWeight: 360.4921

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCC(C2)COC

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCC[C@@H](C2)COC

InChI

InChI=1S/C16H29N3O4S/c1-4-24(20,21)16-17-10-15(19(16)8-9-22-2)12-18-7-5-6-14(11-18)13-23-3/h10,14H,4-9,11-13H2,1-3H3/p+1/t14-/m0/s1