2-azanyl-3-[4-[bis(fluoranyl)-phosphono-methyl]-3-bromanyl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[bis(fluoranyl)-phosphono-methyl]-3-bromanyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[3-bromo-4-[difluoro(phosphono)methyl]phenyl]propanoic acid CAS Name: 2-amino-3-[3-bromo-4-[difluoro(phosphono)methyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-bromo-4-[difluoro(phosphono)methyl]phenyl]propanoic acid Traditional Name: 2-amino-3-[3-bromo-4-[difluoro(phosphono)methyl]phenyl]propionic acid Formula: C10H11BrF2NO5P MolecularWeight: 374.072607

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)N)Br)C(F)(F)P(=O)(O)O

Isomeric SMILES

C1=CC(=C(C=C1CC(C(=O)O)N)Br)C(F)(F)P(=O)(O)O

InChI

InChI=1S/C10H11BrF2NO5P/c11-7-3-5(4-8(14)9(15)16)1-2-6(7)10(12,13)20(17,18)19/h1-3,8H,4,14H2,(H,15,16)(H2,17,18,19)