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

Systemtic Name: 3-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 3-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(2,5-diethoxy-4-methylphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 3-(2,5-diethoxy-4-methylphenyl)sulfonyl-2-phenyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-2-phenyl-2-imidazolin-1-ium Formula: C20H25N2O4S+ MolecularWeight: 389.4885

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C)OCC)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=C(C=C1C)OCC)S(=O)(=O)[N+]2=C(NCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O4S/c1-4-25-17-14-19(18(26-5-2)13-15(17)3)27(23,24)22-12-11-21-20(22)16-9-7-6-8-10-16/h6-10,13-14H,4-5,11-12H2,1-3H3/p+1