3-[(3-chlorophenyl)methylsulfonyl]-1H-benzimidazol-3-ium

Systemtic Name: 3-[(3-chlorophenyl)methylsulfonyl]-1H-benzimidazol-3-ium Openeye Name: 3-[(3-chlorophenyl)methylsulfonyl]-1H-benzimidazol-3-ium CAS Name: 3-[(3-chlorophenyl)methylsulfonyl]-1H-benzimidazol-3-ium IUPAC Name: 3-[(3-chlorophenyl)methylsulfonyl]-1H-benzimidazol-3-ium Traditional Name: 3-(3-chlorobenzyl)sulfonyl-1H-benzimidazol-3-ium Formula: C14H12ClN2O2S+ MolecularWeight: 307.77528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC=[N+]2S(=O)(=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC=[N+]2S(=O)(=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C14H11ClN2O2S/c15-12-5-3-4-11(8-12)9-20(18,19)17-10-16-13-6-1-2-7-14(13)17/h1-8,10H,9H2/p+1