5,7,8a-triphenyl-1,2,3,8-tetrahydroindolizin-4-ium-1-carbonitrile tetrafluoroborate

Systemtic Name: 5,7,8a-triphenyl-1,2,3,8-tetrahydroindolizin-4-ium-1-carbonitrile tetrafluoroborate Openeye Name: 5,7,8a-triphenyl-1,2,3,8-tetrahydroindolizin-4-ium-1-carbonitrile tetrafluoroborate CAS Name: 5,7,8a-triphenyl-1,2,3,8-tetrahydroindolizin-4-ium-1-carbonitrile tetrafluoroborate IUPAC Name: 5,7,8a-triphenyl-1,2,3,8-tetrahydroindolizin-4-ium-1-carbonitrile tetrafluoroborate Traditional Name: 5,7,8a-triphenyl-1,2,3,8-tetrahydroindolizin-4-ium-1-carbonitrile tetrafluoroborate Formula: C27H23BF4N2 MolecularWeight: 462.289533

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1C[N+]2=C(C=C(CC2(C1C#N)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.C1C[N+]2=C(C=C(CC2(C1C#N)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H23N2.BF4/c28-20-25-16-17-29-26(22-12-6-2-7-13-22)18-23(21-10-4-1-5-11-21)19-27(25,29)24-14-8-3-9-15-24;2-1(3,4)5/h1-15,18,25H,16-17,19H2;/q+1;-1