(2E)-7-chloranyl-2-[4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-pyridin-3-ylidene]-1,3-dihydrobenzimidazole-5-carboxylic acid

Systemtic Name: (2E)-7-chloranyl-2-[4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-pyridin-3-ylidene]-1,3-dihydrobenzimidazole-5-carboxylic acid Openeye Name: (2E)-7-chloro-2-[4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-2-oxo-3-pyridylidene]-1,3-dihydrobenzimidazole-5-carboxylic acid CAS Name: (2E)-7-chloro-2-[4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]-2-oxo-3-pyridinylidene]-1,3-dihydrobenzimidazole-5-carboxylic acid IUPAC Name: (2E)-7-chloro-2-[4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]-2-oxopyridin-3-ylidene]-1,3-dihydrobenzimidazole-5-carboxylic acid Traditional Name: (2E)-7-chloro-2-[4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-2-keto-3-pyridylidene]-1,3-dihydrobenzimidazole-5-carboxylic acid Formula: C21H16Cl2N4O4 MolecularWeight: 459.28214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(CNC2=CC=NC(=O)C2=C3NC4=C(N3)C(=CC(=C4)C(=O)O)Cl)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(CNC\2=CC=NC(=O)/C2=C/3\NC4=C(N3)C(=CC(=C4)C(=O)O)Cl)O

InChI

InChI=1S/C21H16Cl2N4O4/c22-12-3-1-2-10(6-12)16(28)9-25-14-4-5-24-20(29)17(14)19-26-15-8-11(21(30)31)7-13(23)18(15)27-19/h1-8,16,25-28H,9H2,(H,30,31)/b19-17+