CAS Registry Number®
7440-84-8
CAS Name
Benzothiazolium, 3-(2-carboxyethyl)-2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-5-chloro-, inner salt
Molecular Formula
C25H22Cl2N2O4S2
Molecular Mass
549.49
Other Names and Identifiers
InChI
InChI=1S/C25H22Cl2N2O4S2/c1-2-15(11-22-28(9-7-24(30)31)18-13-16(26)3-5-20(18)34-22)12-23-29(10-8-25(32)33)19-14-17(27)4-6-21(19)35-23/h3-6,11-14H,2,7-10H2,1H3,(H-,30,31,32,33)
InChIKey
InChIKey=DQSWTRXLMLPWPV-UHFFFAOYSA-N
Canonical SMILES
O=C([O-])CC[N+]1=C(SC=2C=CC(Cl)=CC21)C=C(C=C3SC4=CC=C(Cl)C=C4N3CCC(=O)O)CC
Other Names for this Substance
- Benzothiazolium, 3-(2-carboxyethyl)-2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-5-chloro-, inner salt
- Benzothiazolium, 3-(2-carboxyethyl)-2-[2-[[3-(2-carboxyethyl)-5-chloro-2-benzothiazolinylidene]methyl]-1-butenyl]-5-chloro-, hydroxide, inner salt
- Benzothiazolium, 3-(2-carboxyethyl)-2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-butenyl]-5-chloro-, hydroxide, inner salt
- 3-(2-Carboxyethyl)-2-[2-[[3-(2-carboxyethyl)-5-chloro-2-benzothiazolinylidene]methyl]-1-butenyl]-5-chlorobenzothiazolium hydroxide, inner salt
- Benzothiazolium, 3-(2-carboxyethyl)-2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-butenyl]-5-chloro-, inner salt
