1-[2,4-bis(oxidanyl)phenyl]-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethanone

Systemtic Name: 1-[2,4-bis(oxidanyl)phenyl]-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethanone Openeye Name: 1-(2,4-dihydroxyphenyl)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethanone CAS Name: 1-(2,4-dihydroxyphenyl)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethanone IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethanone Traditional Name: 1-(2,4-dihydroxyphenyl)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)ethanone Formula: C16H15N2O3+ MolecularWeight: 283.3019

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)CC(=O)C3=C(C=C(C=C3)O)O

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)CC(=O)C3=C(C=C(C=C3)O)O

InChI

InChI=1S/C16H14N2O3/c1-18-13-5-3-2-4-12(13)17-16(18)9-15(21)11-7-6-10(19)8-14(11)20/h2-8H,9H2,1H3,(H2,19,20,21)/p+1