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

Systemtic Name: 3-(4-bromanyl-3-ethoxy-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(4-bromo-3-ethoxy-phenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(4-bromo-3-ethoxyphenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(4-bromo-3-ethoxyphenyl)sulfonyl-2-methyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(4-bromo-3-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=CC(=C1)S(=O)(=O)[N+]2=C(NCC2)C)Br

Isomeric SMILES

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

InChI

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