C38H30N10O9S.2Na

disodium;(3Z)-3-[[4-[4-[(2E)-2-[6-amino-5-(2H-benzotriazol-4-yldiazenyl)-1-oxo-3-sulfonatonaphthalen-2-ylidene]hydrazinyl]-3-methoxyphenyl]-2-methoxyphenyl]hydrazinylidene]-4-methyl-6-oxocyclohexa-1,4-diene-1-carboxylate

Also Known As: EINECS 285-798-0|Benzoic acid, 5-((4'-((6-amino-5-(1H-benzotriazol-4-ylazo)-1-hydroxy-3-sulfo-2-naphthalenyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-2-hydroxy-4-methyl-, disodium salt|Benzoic acid, 5-(2-(4'-(2-(6-amino-5-(2-(1H-benzotriazol-7-yl)diazenyl)-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxy-4-methyl-, sodium salt (1:2)|Benzoic acid, 5-[[4'-[[6-amino-5-(1H-benzotriazol-4-ylazo)-1-hydroxy-3-sulfo-2-naphthalenyl]azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-4-methyl-, disodium salt|Disodium 5-[[4'-[[6-amino-5-(1H-benzotriazol-4-ylazo)-1-hydroxy-3-sulphonato-2-naphthyl]azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-4-methylsalicylate

Molecular Formula	C38H28N10Na2O9S
Molecular Weight	846.1557 g/mol
LogP	-1.8286
Topological Polar Surface Area	291.02 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	18
Rotatable Bonds	11
Exact Mass	846.1557
Monoisotopic Mass	846.1557
Heavy Atoms	60
Complexity	2904.5798

Chemical Identifiers

CAS Number	85153-20-4
SMILES	CC\1=CC(=O)C(=C/C1=N/NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5N=NC6=CC=CC7=NNN=C76)N)S(=O)(=O)[O-])OC)OC)C(=O)[O-].[Na+].[Na+]