2-[4-[3-[[1-azanyl-3-[4-[bis(fluoranyl)-phosphono-methyl]phenyl]-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-2-(pyrazin-2-ylcarbonylamino)propyl]phenyl]-2,2-bis(fluoranyl)ethanoic acid

Systemtic Name: 2-[4-[3-[[1-azanyl-3-[4-[bis(fluoranyl)-phosphono-methyl]phenyl]-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-2-(pyrazin-2-ylcarbonylamino)propyl]phenyl]-2,2-bis(fluoranyl)ethanoic acid Openeye Name: 2-[4-[3-[[2-amino-1-[[4-[difluoro(phosphono)methyl]phenyl]methyl]-2-oxo-ethyl]amino]-3-oxo-2-(pyrazine-2-carbonylamino)propyl]phenyl]-2,2-difluoro-acetic acid CAS Name: 2-[4-[3-[[1-amino-3-[4-[difluoro(phosphono)methyl]phenyl]-1-oxopropan-2-yl]amino]-3-oxo-2-[[oxo(2-pyrazinyl)methyl]amino]propyl]phenyl]-2,2-difluoroacetic acid IUPAC Name: 2-[4-[3-[[1-amino-3-[4-[difluoro(phosphono)methyl]phenyl]-1-oxopropan-2-yl]amino]-3-oxo-2-(pyrazine-2-carbonylamino)propyl]phenyl]-2,2-difluoroacetic acid Traditional Name: 2-[4-[3-[[2-amino-1-[4-[difluoro(phosphono)methyl]benzyl]-2-keto-ethyl]amino]-3-keto-2-(pyrazinoylamino)propyl]phenyl]-2,2-difluoro-acetic acid Formula: C26H24F4N5O8P MolecularWeight: 641.464834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)NC(CC2=CC=C(C=C2)C(F)(F)P(=O)(O)O)C(=O)N)NC(=O)C3=NC=CN=C3)C(C(=O)O)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)NC(CC2=CC=C(C=C2)C(F)(F)P(=O)(O)O)C(=O)N)NC(=O)C3=NC=CN=C3)C(C(=O)O)(F)F

InChI

InChI=1S/C26H24F4N5O8P/c27-25(28,24(39)40)16-5-1-15(2-6-16)12-19(35-23(38)20-13-32-9-10-33-20)22(37)34-18(21(31)36)11-14-3-7-17(8-4-14)26(29,30)44(41,42)43/h1-10,13,18-19H,11-12H2,(H2,31,36)(H,34,37)(H,35,38)(H,39,40)(H2,41,42,43)