4-[3,6-Bis(diethylamino)-9H-xanthen-9-yl]-1,3-benzenedisulfonic acid
CAS Registry Number®
85681-99-8
CAS Name
4-[3,6-Bis(diethylamino)-9H-xanthen-9-yl]-1,3-benzenedisulfonic acidMolecular Formula
C27H32N2O7S2Molecular Mass
560.68Cite this Page
4-[3,6-Bis(diethylamino)-9H-xanthen-9-yl]-1,3-benzenedisulfonic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=85681-99-8 (retrieved ) (CAS RN: 85681-99-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C27H32N2O7S2/c1-5-28(6-2)18-9-12-21-24(15-18)36-25-16-19(29(7-3)8-4)10-13-22(25)27(21)23-14-11-20(37(30,31)32)17-26(23)38(33,34)35/h9-17,27H,5-8H2,1-4H3,(H,30,31,32)(H,33,34,35)
InChIKey
InChIKey=ZMQJXVGDHQCYTO-UHFFFAOYSA-N
SMILES
S(=O)(=O)(O)C1=C(C2C=3C(OC=4C2=CC=C(N(CC)CC)C4)=CC(N(CC)CC)=CC3)C=CC(S(=O)(=O)O)=C1
Canonical SMILES
O=S(=O)(O)C1=CC=C(C(=C1)S(=O)(=O)O)C2C3=CC=C(C=C3OC4=CC(=CC=C42)N(CC)CC)N(CC)CC
Other Names for this Substance
- 1,3-Benzenedisulfonic acid, 4-[3,6-bis(diethylamino)-9H-xanthen-9-yl]-
- 4-[3,6-Bis(diethylamino)-9H-xanthen-9-yl]-1,3-benzenedisulfonic acid
