Sodium 2-({4-[(4-{3-[(4-acetamido-5-sulfo-1,3-cyclohexadien-1-yl)hydrazono]-4-oxo-3,4-dihydro-1-naphthalenyl}-6-chloro-1,3,5-triazin-2-yl)amino]-5-methoxy-2-methylphenyl}sulfonyl)ethyl sulfate

SMILES:

[Na+].Clc1nc(nc(n1)Nc2cc(c(cc2OC)S(=O)(=O)CCOS([O-])(=O)=O)C)/C4=C/C(=NN\C3=C\C=C(\NC(=O)C)C(S(=O)(=O)O)C3)C(=O)c5ccccc45 CopyCopied

Std. InChI:

InChI=1S/C31H30ClN7O12S3.Na/c1-16-12-23(25(50-3)15-26(16)52(42,43)11-10-51-54(47,48)49)34-31-36-29(35-30(32)37-31)21-14-24(28(41)20-7-5-4-6-19(20)21)39-38-18-8-9-22(33-17(2)40)27(13-18)53(44,45)46;/h4-9,12,14-15,27,38H,10-11,13H2,1-3H3,(H,33,40)(H,44,45,46)(H,47,48,49)(H,34,35,36,37);/q;+1/p-1 CopyCopied

Std. InChIKey:

XNXYVNSABZQOAO-UHFFFAOYSA-M CopyCopied

CSID:5199850, http://www.chemspider.com/Chemical-Structure.5199850.html (accessed 23:05, Jun 19, 2013) CopyCopied