1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]azepan-1-ium

Systemtic Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]azepan-1-ium Openeye Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]azepan-1-ium CAS Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]azepan-1-ium IUPAC Name: 1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]azepan-1-ium Traditional Name: 1-[[2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]azepan-1-ium Formula: C15H28N3O3S+ MolecularWeight: 330.46612

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCCCC2

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCCCC2

InChI

InChI=1S/C15H27N3O3S/c1-3-22(19,20)15-16-12-14(18(15)10-11-21-2)13-17-8-6-4-5-7-9-17/h12H,3-11,13H2,1-2H3/p+1