2-(5-methoxy-1H-indol-3-yl)ethyl-triphenyl-azanium tetrafluoroborate

Systemtic Name: 2-(5-methoxy-1H-indol-3-yl)ethyl-triphenyl-azanium tetrafluoroborate Openeye Name: 2-(5-methoxy-1H-indol-3-yl)ethyl-triphenyl-ammonium tetrafluoroborate CAS Name: 2-(5-methoxy-1H-indol-3-yl)ethyl-triphenylammonium tetrafluoroborate IUPAC Name: 2-(5-methoxy-1H-indol-3-yl)ethyl-triphenylazanium tetrafluoroborate Traditional Name: 2-(5-methoxy-1H-indol-3-yl)ethyl-triphenyl-ammonium tetrafluoroborate Formula: C29H27BF4N2O MolecularWeight: 506.342093

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC1=CC2=C(C=C1)NC=C2CC[N+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.COC1=CC2=C(C=C1)NC=C2CC[N+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H27N2O.BF4/c1-32-27-17-18-29-28(21-27)23(22-30-29)19-20-31(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26;2-1(3,4)5/h2-18,21-22,30H,19-20H2,1H3;/q+1;-1