[(3-bromanyl-7-cyano-naphthalen-2-yl)-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [(3-bromanyl-7-cyano-naphthalen-2-yl)-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [(3-bromo-7-cyano-2-naphthyl)-difluoro-methyl]phosphonic acid CAS Name: [(3-bromo-7-cyano-2-naphthalenyl)-difluoromethyl]phosphonic acid IUPAC Name: [(3-bromo-7-cyanonaphthalen-2-yl)-difluoromethyl]phosphonic acid Traditional Name: [(3-bromo-7-cyano-2-naphthyl)-difluoro-methyl]phosphonic acid Formula: C12H7BrF2NO3P MolecularWeight: 362.063447

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=C(C=C2C=C1C#N)C(F)(F)P(=O)(O)O)Br

Isomeric SMILES

C1=CC2=CC(=C(C=C2C=C1C#N)C(F)(F)P(=O)(O)O)Br

InChI

InChI=1S/C12H7BrF2NO3P/c13-11-5-8-2-1-7(6-16)3-9(8)4-10(11)12(14,15)20(17,18)19/h1-5H,(H2,17,18,19)