[3-[[6-chloranyl-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]phenyl]phosphonic acid

Systemtic Name: [3-[[6-chloranyl-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]phenyl]phosphonic acid Openeye Name: [3-[[6-chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]phenyl]phosphonic acid CAS Name: [3-[[6-chloro-5-(1-methyl-5-indolyl)-1H-benzimidazol-2-yl]oxy]phenyl]phosphonic acid IUPAC Name: [3-[[6-chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]phenyl]phosphonic acid Traditional Name: [3-[[6-chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]phenyl]phosphonic acid Formula: C22H17ClN3O4P MolecularWeight: 453.814841

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)C3=CC4=C(C=C3Cl)NC(=N4)OC5=CC(=CC=C5)P(=O)(O)O

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)C3=CC4=C(C=C3Cl)NC(=N4)OC5=CC(=CC=C5)P(=O)(O)O

InChI

InChI=1S/C22H17ClN3O4P/c1-26-8-7-14-9-13(5-6-21(14)26)17-11-19-20(12-18(17)23)25-22(24-19)30-15-3-2-4-16(10-15)31(27,28)29/h2-12H,1H3,(H,24,25)(H2,27,28,29)