3-(3,4-dimethoxyphenyl)sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium

Systemtic Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 2-benzyl-3-(3,4-dimethoxyphenyl)sulfonyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 2-benzyl-3-(3,4-dimethoxyphenyl)sulfonyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 2-benzyl-1-(3,4-dimethoxyphenyl)sulfonyl-2-imidazolin-1-ium Formula: C18H21N2O4S+ MolecularWeight: 361.43534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)[N+]2=C(NCC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)[N+]2=C(NCC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C18H20N2O4S/c1-23-16-9-8-15(13-17(16)24-2)25(21,22)20-11-10-19-18(20)12-14-6-4-3-5-7-14/h3-9,13H,10-12H2,1-2H3/p+1