Name: | CI ACID RED 85 |
CAS: | 3567-65-5 |
Synonyms: | CI ACID RED 85 |
MDL.: | MFCD00071910 |
H bond acceptor: | 14 |
H bond donor: | 1 |
Smile: | Cc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)/N=N/c3ccc(cc3)c4ccc(cc4)/N=N/c5c(ccc6c5c(cc(c6)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+] |
InChi: | InChI=1S/C35H26N4O10S3.2Na/c1-22-2-17-30(18-3-22)52(47,48)49-29-15-13-28(14-16-29)37-36-26-9-4-23(5-10-26)24-6-11-27(12-7-24)38-39-35-32(40)19-8-25-20-31(50(41,42)43)21-33(34(25)35)51(44,45)46;;/h2-21,40H,1H3,(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2/b37-36+,39-38+;; |
InChiKey: | InChIKey=SVSHEAJPDAGGCC-FBBBJYKDSA-L |
CI ACID RED 85
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