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Phenazinium, 3-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]amino]-7-[ethyl[(3-sulfophenyl)methyl]amino]-5-(4-methoxy-3-sulfophenyl)-, inner salt
CAS Registry Number®
55772-05-9
CAS Name
Phenazinium, 3-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]amino]-7-[ethyl[(3-sulfophenyl)methyl]amino]-5-(4-methoxy-3-sulfophenyl)-, inner saltMolecular Formula
C37H30Cl2N8O10S3Molecular Mass
913.79Cite this Page
Phenazinium, 3-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]amino]-7-[ethyl[(3-sulfophenyl)methyl]amino]-5-(4-methoxy-3-sulfophenyl)-, inner salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=55772-05-9 (retrieved ) (CAS RN: 55772-05-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).ADVERTISEMENT
Other Names and Identifiers
InChI
InChI=1S/C37H30Cl2N8O10S3/c1-3-46(20-21-5-4-6-26(15-21)58(48,49)50)24-9-13-28-31(18-24)47(25-10-14-32(57-2)34(19-25)60(54,55)56)30-16-22(7-11-27(30)42-28)40-29-12-8-23(17-33(29)59(51,52)53)41-37-44-35(38)43-36(39)45-37/h4-19H,3,20H2,1-2H3,(H4,41,42,43,44,45,48,49,50,51,52,53,54,55,56)
InChIKey
InChIKey=ALKRMTFICZQUIM-UHFFFAOYSA-N
SMILES
N(CC1=CC(S(=O)(=O)O)=CC=C1)(CC)C2=CC=3[N+](=C4C(=NC3C=C2)C=CC(NC5=C(S(=O)(=O)[O-])C=C(NC=6N=C(Cl)N=C(Cl)N6)C=C5)=C4)C7=CC(S(=O)(=O)O)=C(OC)C=C7
Canonical SMILES
O=S(=O)([O-])C1=CC(=CC=C1NC=2C=CC=3N=C4C=CC(=CC4=[N+](C=5C=CC(OC)=C(C5)S(=O)(=O)O)C3C2)N(CC6=CC=CC(=C6)S(=O)(=O)O)CC)NC=7N=C(Cl)N=C(Cl)N7
Other Names for this Substance
- Phenazinium, 3-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]amino]-7-[ethyl[(3-sulfophenyl)methyl]amino]-5-(4-methoxy-3-sulfophenyl)-, inner salt
- Phenazinium, 3-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]amino]-7-[ethyl[(3-sulfophenyl)methyl]amino]-5-(4-methoxy-3-sulfophenyl)-, hydroxide, inner salt
