Registration Dossier

Reference substances

Reference substances

Currently viewing:
IUPAC name:
disodium 2-({4-[ethyl(3-sulfonatobenzyl)amino]phenyl}{4-[ethyl(3-sulfonatobenzyl)iminio]cyclohexa-2,...

Inventory

EC number:
219-091-5
EC name:
Dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)amino](4-hydroxy-2-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, disodium salt
CAS number:
2353-45-9
CAS number:
2353-45-9

Synonyms

Molecular and structural information

Molecular formula:
C37H36N2O10S3.2Na
Molecular weight:
808.858
SMILES notation:
C(=C1\C=C\C(=[N+](\Cc2cc(ccc2)S(=O)(=O)[O-])CC)C=C1)(/c1c(cc(cc1)O)S(=O)(=O)O)c1ccc(cc1)N(Cc1cc(ccc1)S(=O)(=O)O)CC.[Na].[Na]
InChl:
1S/C37H36N2O10S3.2Na/c1-3-38(24-26-7-5-9-33(21-26)50(41,42)43)30-15-11-28(12-16-30)37(35-20-19-32(40)23-36(35)52(47,48)49)29-13-17-31(18-14-29)39(4-2)25-27-8-6-10-34(22-27)51(44,45)46;;/h5-23H,3-4,24-25H2,1-2H3,(H3,41,42,43,44,45,46,47,48,49);;/q;2*+1/p-2
Structural formula:
Chemical structure

Related substances