1H-Indolium, 1-[(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-2,3-dihydro-5-methoxy-2,3,3-trimethyl-, acetate

83949-82-0

CAS Name

1H-Indolium, 1-[2-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-2,3-dihydro-5-methoxy-2,3,3-trimethyl-, acetate (1:1)

Molecular Formula

C₂₅H₃₁N₂O.C₂H₃O₂

Other Names and Identifiers

InChI

InChI=1S/C25H31N2O.C2H4O2/c1-17-24(2,3)20-16-18(28-7)12-13-22(20)27(17)15-14-23-25(4,5)19-10-8-9-11-21(19)26(23)6;1-2(3)4/h8-17H,1-7H3;1H3,(H,3,4)/q+1;/p-1

InChIKey

InChIKey=WNXQKWADOSVZGV-UHFFFAOYSA-M

SMILES

C(C=C1C(C)(C)C=2C(N1C)=CC=CC2)=[N+]3C=4C(C(C)(C)C3C)=CC(OC)=CC4.C(C)([O-])=O

Canonical SMILES

O=C([O-])C.O(C1=CC=C2C(=C1)C(C)(C)C([N+]2=CC=C3N(C=4C=CC=CC4C3(C)C)C)C)C

Other Names for this Substance