[[4-(2-acetamidoethyl)-2-bromanyl-phenyl]-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [[4-(2-acetamidoethyl)-2-bromanyl-phenyl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[4-(2-acetamidoethyl)-2-bromo-phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[4-(2-acetamidoethyl)-2-bromophenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[4-(2-acetamidoethyl)-2-bromophenyl]-difluoromethyl]phosphonic acid Traditional Name: [[4-(2-acetamidoethyl)-2-bromo-phenyl]-difluoro-methyl]phosphonic acid Formula: C11H13BrF2NO4P MolecularWeight: 372.099787

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC(=C(C=C1)C(F)(F)P(=O)(O)O)Br

Isomeric SMILES

CC(=O)NCCC1=CC(=C(C=C1)C(F)(F)P(=O)(O)O)Br

InChI

InChI=1S/C11H13BrF2NO4P/c1-7(16)15-5-4-8-2-3-9(10(12)6-8)11(13,14)20(17,18)19/h2-3,6H,4-5H2,1H3,(H,15,16)(H2,17,18,19)