[5-(7-bromanyl-6-chloranyl-4,5-dimethyl-1H-benzimidazol-2-yl)furan-2-yl]phosphonic acid

Systemtic Name: [5-(7-bromanyl-6-chloranyl-4,5-dimethyl-1H-benzimidazol-2-yl)furan-2-yl]phosphonic acid Openeye Name: [5-(7-bromo-6-chloro-4,5-dimethyl-1H-benzimidazol-2-yl)-2-furyl]phosphonic acid CAS Name: [5-(7-bromo-6-chloro-4,5-dimethyl-1H-benzimidazol-2-yl)-2-furanyl]phosphonic acid IUPAC Name: [5-(7-bromo-6-chloro-4,5-dimethyl-1H-benzimidazol-2-yl)furan-2-yl]phosphonic acid Traditional Name: [5-(7-bromo-6-chloro-4,5-dimethyl-1H-benzimidazol-2-yl)-2-furyl]phosphonic acid Formula: C13H11BrClN2O4P MolecularWeight: 405.568201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N=C(N2)C3=CC=C(O3)P(=O)(O)O)Br)Cl)C

Isomeric SMILES

CC1=C(C(=C(C2=C1N=C(N2)C3=CC=C(O3)P(=O)(O)O)Br)Cl)C

InChI

InChI=1S/C13H11BrClN2O4P/c1-5-6(2)11-12(9(14)10(5)15)17-13(16-11)7-3-4-8(21-7)22(18,19)20/h3-4H,1-2H3,(H,16,17)(H2,18,19,20)