2-[(E)-2-(3-fluorophenyl)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzenediazonium tetrafluoroborate

Systemtic Name: 2-[(E)-2-(3-fluorophenyl)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzenediazonium tetrafluoroborate Openeye Name: 2-[(E)-2-(3-fluorophenyl)-3-methoxy-3-oxo-prop-1-enyl]benzenediazonium tetrafluoroborate CAS Name: 2-[(E)-2-(3-fluorophenyl)-3-methoxy-3-oxoprop-1-enyl]benzenediazonium tetrafluoroborate IUPAC Name: 2-[(E)-2-(3-fluorophenyl)-3-methoxy-3-oxoprop-1-enyl]benzenediazonium tetrafluoroborate Traditional Name: 2-[(E)-2-(3-fluorophenyl)-3-keto-3-methoxy-prop-1-enyl]benzenediazonium tetrafluoroborate Formula: C16H12BF5N2O2 MolecularWeight: 370.081696

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC(=O)C(=CC1=CC=CC=C1[N+]#N)C2=CC(=CC=C2)F

Isomeric SMILES

[B-](F)(F)(F)F.COC(=O)/C(=C/C1=CC=CC=C1[N+]#N)/C2=CC(=CC=C2)F

InChI

InChI=1S/C16H12FN2O2.BF4/c1-21-16(20)14(11-6-4-7-13(17)9-11)10-12-5-2-3-8-15(12)19-18;2-1(3,4)5/h2-10H,1H3;/q+1;-1/b14-10+;