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

Systemtic Name: [[4-(2-benzamidoethyl)-2-bromanyl-phenyl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[4-(2-benzamidoethyl)-2-bromo-phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[4-(2-benzamidoethyl)-2-bromophenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[4-(2-benzamidoethyl)-2-bromophenyl]-difluoromethyl]phosphonic acid Traditional Name: [[4-(2-benzamidoethyl)-2-bromo-phenyl]-difluoro-methyl]phosphonic acid Formula: C16H15BrF2NO4P MolecularWeight: 434.169167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCC2=CC(=C(C=C2)C(F)(F)P(=O)(O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCC2=CC(=C(C=C2)C(F)(F)P(=O)(O)O)Br

InChI

InChI=1S/C16H15BrF2NO4P/c17-14-10-11(6-7-13(14)16(18,19)25(22,23)24)8-9-20-15(21)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,20,21)(H2,22,23,24)