1-(1-fluoranylcyclohexa-2,4-dien-1-yl)-1H-pyrrol-1-ium; tetrabutylboranuide

Systemtic Name: 1-(1-fluoranylcyclohexa-2,4-dien-1-yl)-1H-pyrrol-1-ium; tetrabutylboranuide Openeye Name: 1-(1-fluorocyclohexa-2,4-dien-1-yl)-1H-pyrrol-1-ium; tetrabutylboranuide CAS Name: 1-(1-fluoro-1-cyclohexa-2,4-dienyl)-1H-pyrrol-1-ium; tetrabutylboranuide IUPAC Name: 1-(1-fluorocyclohexa-2,4-dien-1-yl)-1H-pyrrol-1-ium; tetrabutylboranuide Traditional Name: 1-(1-fluorocyclohexa-2,4-dien-1-yl)-1H-pyrrol-1-ium; tetrabutylboranuide Formula: C26H47BFN MolecularWeight: 403.467483

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Descriptors Computed from Structure

Canonical SMILES:

[B-](CCCC)(CCCC)(CCCC)CCCC.C1C=CC=CC1([NH+]2C=CC=C2)F

Isomeric SMILES

[B-](CCCC)(CCCC)(CCCC)CCCC.C1C=CC=CC1([NH+]2C=CC=C2)F

InChI

InChI=1S/C16H36B.C10H10FN/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;11-10(6-2-1-3-7-10)12-8-4-5-9-12/h5-16H2,1-4H3;1-6,8-9H,7H2/q-1;/p+1