[3-(7-azanyl-4-ethyl-6-fluoranyl-1H-benzimidazol-2-yl)-3-(2-methylpropyl)oxiran-2-yl]phosphonic acid

Systemtic Name: [3-(7-azanyl-4-ethyl-6-fluoranyl-1H-benzimidazol-2-yl)-3-(2-methylpropyl)oxiran-2-yl]phosphonic acid Openeye Name: [3-(7-amino-4-ethyl-6-fluoro-1H-benzimidazol-2-yl)-3-isobutyl-oxiran-2-yl]phosphonic acid CAS Name: [3-(7-amino-4-ethyl-6-fluoro-1H-benzimidazol-2-yl)-3-(2-methylpropyl)-2-oxiranyl]phosphonic acid IUPAC Name: [3-(7-amino-4-ethyl-6-fluoro-1H-benzimidazol-2-yl)-3-(2-methylpropyl)oxiran-2-yl]phosphonic acid Traditional Name: [3-(7-amino-4-ethyl-6-fluoro-1H-benzimidazol-2-yl)-3-isobutyl-oxiran-2-yl]phosphonic acid Formula: C15H21FN3O4P MolecularWeight: 357.317104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C2=C1N=C(N2)C3(C(O3)P(=O)(O)O)CC(C)C)N)F

Isomeric SMILES

CCC1=CC(=C(C2=C1N=C(N2)C3(C(O3)P(=O)(O)O)CC(C)C)N)F

InChI

InChI=1S/C15H21FN3O4P/c1-4-8-5-9(16)10(17)12-11(8)18-13(19-12)15(6-7(2)3)14(23-15)24(20,21)22/h5,7,14H,4,6,17H2,1-3H3,(H,18,19)(H2,20,21,22)