[2-[4-azanyl-5-bromanyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid

Systemtic Name: [2-[4-azanyl-5-bromanyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid Openeye Name: [2-(4-amino-5-bromo-1-isobutyl-benzimidazol-2-yl)-3-furyl]phosphonic acid CAS Name: [2-[4-amino-5-bromo-1-(2-methylpropyl)-2-benzimidazolyl]-3-furanyl]phosphonic acid IUPAC Name: [2-[4-amino-5-bromo-1-(2-methylpropyl)benzimidazol-2-yl]furan-3-yl]phosphonic acid Traditional Name: [2-(4-amino-5-bromo-1-isobutyl-benzimidazol-2-yl)-3-furyl]phosphonic acid Formula: C15H17BrN3O4P MolecularWeight: 414.190941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=C(C=C2)Br)N)N=C1C3=C(C=CO3)P(=O)(O)O

Isomeric SMILES

CC(C)CN1C2=C(C(=C(C=C2)Br)N)N=C1C3=C(C=CO3)P(=O)(O)O

InChI

InChI=1S/C15H17BrN3O4P/c1-8(2)7-19-10-4-3-9(16)12(17)13(10)18-15(19)14-11(5-6-23-14)24(20,21)22/h3-6,8H,7,17H2,1-2H3,(H2,20,21,22)