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

Systemtic Name: 3-(4-iodophenyl)sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium Openeye Name: 2-benzyl-3-(4-iodophenyl)sulfonyl-4,5-dihydro-1H-imidazol-3-ium CAS Name: 3-(4-iodophenyl)sulfonyl-2-(phenylmethyl)-4,5-dihydro-1H-imidazol-3-ium IUPAC Name: 2-benzyl-3-(4-iodophenyl)sulfonyl-4,5-dihydro-1H-imidazol-3-ium Traditional Name: 2-benzyl-1-(4-iodophenyl)sulfonyl-2-imidazolin-1-ium Formula: C16H16IN2O2S+ MolecularWeight: 427.27991

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C(N1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1C[N+](=C(N1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C16H15IN2O2S/c17-14-6-8-15(9-7-14)22(20,21)19-11-10-18-16(19)12-13-4-2-1-3-5-13/h1-9H,10-12H2/p+1