1,3,3-Trimethyl-2-[(1E,3E,5E)-5-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-3H-indolium tetraphenylborate(1-)
[CAS# 91419-03-3]

Identification

• Name: 1,3,3-Trimethyl-2-[(1E,3E,5E)-5-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-3H-indolium tetraphenylborate(1-)
• Synonyms: 1,3,3-trimethyl-2-[(1E,3E)-5-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1,3-pentadienyl]-3H-indolium tetraphenylborate; 3H-Indolium, 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1,3,3-trimethyl-, tetraphenylborate(1-) (9CI); ; Borate(1-), tetraphenyl-, 2-[5-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3-pentadienyl]-1,3,3-trimethyl-3H-indolium
• Molecular Formula: C₅₁H₅₁BN₂
• Molecular Weight: 702.78
• CAS Registry Number: 91419-03-3
• SMILES: [B-](c1ccccc1)(c2ccccc2)(c3ccccc3)c4ccccc4.CC1(c2ccccc2[N+](=C1C=CC=CC=C3C(c4ccccc4N3C)(C)C)C)C
• InChI: 1S/C27H31N2.C24H20B/c1-26(2)20-14-10-12-16-22(20)28(5)24(26)18-8-7-9-19-25-27(3,4)21-15-11-13-17-23(21)29(25)6;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h7-19H,1-6H3;1-20H/q+1;-1
• InChIKey: XPKJECOBGOQSME-UHFFFAOYSA-N