Ethanedioic acid, ion(1-), 2-[2-[4-(diethylamino)phenyl]ethenyl]-1,3,3-trimethyl-3H-indolium

83969-11-3

CAS Name

3H-Indolium, 2-[2-[4-(diethylamino)phenyl]ethenyl]-1,3,3-trimethyl-, ethanedioate (1:1)

Molecular Formula

C₂₃H₂₉N₂.C₂HO₄

Other Names and Identifiers

InChI

InChI=1S/C23H29N2.C2H2O4/c1-6-25(7-2)19-15-12-18(13-16-19)14-17-22-23(3,4)20-10-8-9-11-21(20)24(22)5;3-1(4)2(5)6/h8-17H,6-7H2,1-5H3;(H,3,4)(H,5,6)/q+1;/p-1

InChIKey

InChIKey=BSGDWLGKCUSZNT-UHFFFAOYSA-M

SMILES

C[N+]=1C=2C(C(C)(C)C1C=CC3=CC=C(N(CC)CC)C=C3)=CC=CC2.C(C(O)=O)([O-])=O

Canonical SMILES

O=C([O-])C(=O)O.C=1C=CC2=C(C1)[N+](=C(C=CC3=CC=C(C=C3)N(CC)CC)C2(C)C)C

Other Names for this Substance