[1-[4-azanyl-7-ethyl-5-fluoranyl-1-(2-methylpropyl)benzimidazol-2-yl]-1-oxidanyl-propyl]phosphonic acid

Systemtic Name: [1-[4-azanyl-7-ethyl-5-fluoranyl-1-(2-methylpropyl)benzimidazol-2-yl]-1-oxidanyl-propyl]phosphonic acid Openeye Name: [1-(4-amino-7-ethyl-5-fluoro-1-isobutyl-benzimidazol-2-yl)-1-hydroxy-propyl]phosphonic acid CAS Name: [1-[4-amino-7-ethyl-5-fluoro-1-(2-methylpropyl)-2-benzimidazolyl]-1-hydroxypropyl]phosphonic acid IUPAC Name: [1-[4-amino-7-ethyl-5-fluoro-1-(2-methylpropyl)benzimidazol-2-yl]-1-hydroxypropyl]phosphonic acid Traditional Name: [1-(4-amino-7-ethyl-5-fluoro-1-isobutyl-benzimidazol-2-yl)-1-hydroxy-propyl]phosphonic acid Formula: C16H25FN3O4P MolecularWeight: 373.359564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C2=C1N(C(=N2)C(CC)(O)P(=O)(O)O)CC(C)C)N)F

Isomeric SMILES

CCC1=CC(=C(C2=C1N(C(=N2)C(CC)(O)P(=O)(O)O)CC(C)C)N)F

InChI

InChI=1S/C16H25FN3O4P/c1-5-10-7-11(17)12(18)13-14(10)20(8-9(3)4)15(19-13)16(21,6-2)25(22,23)24/h7,9,21H,5-6,8,18H2,1-4H3,(H2,22,23,24)