Benz[cd]indolium, 6-bromo-2-[4-(diethylamino)phenyl]-1-ethyl-, acetate

83950-28-1

CAS Name

Benz[cd]indolium, 6-bromo-2-[4-(diethylamino)phenyl]-1-ethyl-, acetate (1:1)

Molecular Formula

C₂₃H₂₄BrN₂.C₂H₃O₂

Other Names and Identifiers

InChI

InChI=1S/C23H24BrN2.C2H4O2/c1-4-25(5-2)17-12-10-16(11-13-17)23-19-9-7-8-18-20(24)14-15-21(22(18)19)26(23)6-3;1-2(3)4/h7-15H,4-6H2,1-3H3;1H3,(H,3,4)/q+1;/p-1

InChIKey

InChIKey=CTIBPKYLWXPIQP-UHFFFAOYSA-M

SMILES

C(C)[N+]=1C=2C3=C(C1C4=CC=C(N(CC)CC)C=C4)C=CC=C3C(Br)=CC2.C(C)([O-])=O

Canonical SMILES

O=C([O-])C.BrC1=CC=C2C3=C1C=CC=C3C(C=4C=CC(=CC4)N(CC)CC)=[N+]2CC

Other Names for this Substance