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

Systemtic Name: 3-(5-bromanyl-2-methoxy-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(5-bromo-2-methoxy-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(5-bromo-2-methoxyphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(5-bromo-2-methoxyphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(5-bromo-2-methoxy-phenyl)sulfonyl-2-phenyl-2-imidazolin-1-ium Formula: C16H16BrN2O3S+ MolecularWeight: 396.27884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3

InChI

InChI=1S/C16H15BrN2O3S/c1-22-14-8-7-13(17)11-15(14)23(20,21)19-10-9-18-16(19)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3/p+1