6-(1-oxidanidylpyridin-1-ium-4-yl)sulfonyl-2-(phenoxymethyl)-1H-benzimidazole

Systemtic Name: 6-(1-oxidanidylpyridin-1-ium-4-yl)sulfonyl-2-(phenoxymethyl)-1H-benzimidazole Openeye Name: 6-(1-oxidopyridin-1-ium-4-yl)sulfonyl-2-(phenoxymethyl)-1H-benzimidazole CAS Name: 6-[(1-oxido-4-pyridin-1-iumyl)sulfonyl]-2-(phenoxymethyl)-1H-benzimidazole IUPAC Name: 6-(1-oxidopyridin-1-ium-4-yl)sulfonyl-2-(phenoxymethyl)-1H-benzimidazole Traditional Name: 6-(1-oxidopyridin-1-ium-4-yl)sulfonyl-2-(phenoxymethyl)-1H-benzimidazole Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NC3=C(N2)C=C(C=C3)S(=O)(=O)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NC3=C(N2)C=C(C=C3)S(=O)(=O)C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C19H15N3O4S/c23-22-10-8-15(9-11-22)27(24,25)16-6-7-17-18(12-16)21-19(20-17)13-26-14-4-2-1-3-5-14/h1-12H,13H2,(H,20,21)