diazanium (Z)-3-[3-[bis(fluoranyl)-phosphonato-methyl]phenyl]prop-2-enenitrile

Systemtic Name: diazanium (Z)-3-[3-[bis(fluoranyl)-phosphonato-methyl]phenyl]prop-2-enenitrile Openeye Name: diammonium (Z)-3-[3-[difluoro(phosphonato)methyl]phenyl]prop-2-enenitrile CAS Name: diammonium (Z)-3-[3-[difluoro(phosphonato)methyl]phenyl]-2-propenenitrile IUPAC Name: diazanium (Z)-3-[3-[difluoro(phosphonato)methyl]phenyl]prop-2-enenitrile Traditional Name: diammonium (Z)-3-[3-[difluoro(phosphonato)methyl]phenyl]acrylonitrile Formula: C10H14F2N3O3P MolecularWeight: 293.207027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)P(=O)([O-])[O-])C=CC#N.[NH4+].[NH4+]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)P(=O)([O-])[O-])/C=C\C#N.[NH4+].[NH4+]

InChI

InChI=1S/C10H8F2NO3P.2H3N/c11-10(12,17(14,15)16)9-5-1-3-8(7-9)4-2-6-13;;/h1-5,7H,(H2,14,15,16);2*1H3/b4-2-;;