(4-acetyloxyphenyl)-oxidanylidene-[4-[6-(pyridin-2-ylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]azanium

Systemtic Name: (4-acetyloxyphenyl)-oxidanylidene-[4-[6-(pyridin-2-ylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]azanium Openeye Name: (4-acetoxyphenyl)-oxo-[4-[6-(2-pyridylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]ammonium CAS Name: (4-acetyloxyphenyl)-oxo-[4-[6-[oxo-(2-pyridinylamino)methyl]-1H-benzimidazol-2-yl]phenyl]ammonium IUPAC Name: (4-acetyloxyphenyl)-oxo-[4-[6-(pyridin-2-ylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]azanium Traditional Name: (4-acetoxyphenyl)-keto-[4-[6-(2-pyridylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]ammonium Formula: C27H20N5O4+ MolecularWeight: 478.4788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)[N+](=O)C2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)NC5=CC=CC=N5

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)[N+](=O)C2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)NC5=CC=CC=N5

InChI

InChI=1S/C27H19N5O4/c1-17(33)36-22-12-10-21(11-13-22)32(35)20-8-5-18(6-9-20)26-29-23-14-7-19(16-24(23)30-26)27(34)31-25-4-2-3-15-28-25/h2-16H,1H3,(H-,28,29,30,31,34,35)/p+1