Ethanol, 2,2′,2′′-nitrilotris-, 3-[[4-[(2,4-dimethyl-6-sulfophenyl)azo]-2-methoxy-5-methylphenyl]azo]-4-hydroxy-7-(phenylamino)-2-naphthalenesulfonate (salt), sodium salt

CAS Name

2-Naphthalenesulfonic acid, 3-[2-[4-[2-(2,4-dimethyl-6-sulfophenyl)diazenyl]-2-methoxy-5-methylphenyl]diazenyl]-4-hydroxy-7-(phenylamino)-, sodium salt, compd. with 2,2′,2′′-nitrilotris[ethanol] (1:?:?)

Molecular Formula

C₃₂H₂₉N₅O₈S₂.xC₆H₁₅NO₃.xNa

Other Names and Identifiers

InChI

InChI=1S/C32H29N5O8S2.C6H15NO3.Na/c1-18-12-20(3)30(28(13-18)46(39,40)41)36-34-25-17-27(45-4)26(14-19(25)2)35-37-31-29(47(42,43)44)16-21-15-23(10-11-24(21)32(31)38)33-22-8-6-5-7-9-22;8-4-1-7(2-5-9)3-6-10;/h5-17,33,38H,1-4H3,(H,39,40,41)(H,42,43,44);8-10H,1-6H2;

InChIKey

InChIKey=CFYOGYJGWNEYFE-UHFFFAOYSA-N

SMILES

OC=1C2=C(C=C(S(=O)(=O)O)C1N=NC3=C(OC)C=C(N=NC4=C(S(=O)(=O)O)C=C(C)C=C4C)C(C)=C3)C=C(NC5=CC=CC=C5)C=C2.N(CCO)(CCO)CCO.[Na]

Canonical SMILES

[Na].O=S(=O)(O)C=1C=C2C=C(C=CC2=C(O)C1N=NC3=CC(=C(N=NC=4C(=CC(=CC4S(=O)(=O)O)C)C)C=C3OC)C)NC=5C=CC=CC5.OCCN(CCO)CCO

Other Names for this Substance