[5-[4-azanyl-1-(cyclopropylmethyl)-5-fluoranyl-benzimidazol-2-yl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[4-azanyl-1-(cyclopropylmethyl)-5-fluoranyl-benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-[4-amino-1-(cyclopropylmethyl)-5-fluoro-benzimidazol-2-yl]-2-furyl]phosphonic acid CAS Name: [5-[4-amino-1-(cyclopropylmethyl)-5-fluoro-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[4-amino-1-(cyclopropylmethyl)-5-fluorobenzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-[4-amino-1-(cyclopropylmethyl)-5-fluoro-benzimidazol-2-yl]-2-furyl]phosphonic acid Formula: C15H15FN3O4P MolecularWeight: 351.269464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C(=C(C=C3)F)N)N=C2C4=CC=C(O4)P(=O)(O)O

Isomeric SMILES

C1CC1CN2C3=C(C(=C(C=C3)F)N)N=C2C4=CC=C(O4)P(=O)(O)O

InChI

InChI=1S/C15H15FN3O4P/c16-9-3-4-10-14(13(9)17)18-15(19(10)7-8-1-2-8)11-5-6-12(23-11)24(20,21)22/h3-6,8H,1-2,7,17H2,(H2,20,21,22)