3-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium

Systemtic Name: 3-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(5-bromo-2-ethoxy-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(5-bromo-2-ethoxyphenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(5-bromo-2-ethoxyphenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-2-methyl-2-imidazolin-1-ium Formula: C12H16BrN2O3S+ MolecularWeight: 348.23604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)[N+]2=C(NCC2)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)[N+]2=C(NCC2)C

InChI

InChI=1S/C12H15BrN2O3S/c1-3-18-11-5-4-10(13)8-12(11)19(16,17)15-7-6-14-9(15)2/h4-5,8H,3,6-7H2,1-2H3/p+1