2-[5-chloranyl-2-(5-phosphonofuran-2-yl)benzimidazol-1-yl]benzoic acid

Systemtic Name: 2-[5-chloranyl-2-(5-phosphonofuran-2-yl)benzimidazol-1-yl]benzoic acid Openeye Name: 2-[5-chloro-2-(5-phosphono-2-furyl)benzimidazol-1-yl]benzoic acid CAS Name: 2-[5-chloro-2-(5-phosphono-2-furanyl)-1-benzimidazolyl]benzoic acid IUPAC Name: 2-[5-chloro-2-(5-phosphonofuran-2-yl)benzimidazol-1-yl]benzoic acid Traditional Name: 2-[5-chloro-2-(5-phosphono-2-furyl)benzimidazol-1-yl]benzoic acid Formula: C18H12ClN2O6P MolecularWeight: 418.724441

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)N2C3=C(C=C(C=C3)Cl)N=C2C4=CC=C(O4)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)N2C3=C(C=C(C=C3)Cl)N=C2C4=CC=C(O4)P(=O)(O)O

InChI

InChI=1S/C18H12ClN2O6P/c19-10-5-6-14-12(9-10)20-17(15-7-8-16(27-15)28(24,25)26)21(14)13-4-2-1-3-11(13)18(22)23/h1-9H,(H,22,23)(H2,24,25,26)