ACID BROWN 83

CAS No.
13011-68-2
CCD No.
CCD00248422
Formula
C18 H11 Cu N6 O8 S . Na
MolWeight
557.921

Basic Information

Product Name: ACID BROWN 83
CAS: 13011-68-2
English Synonyms: ACID BROWN 83
MDL Number.: MFCD01734114
H bond acceptor: 14
H bond donor: 2
Smile: c1cc(c(cc1/N=N/c2cc(cc\3c2O[Cu]Oc4ccc(cc4/N=N3)S(=O)(=O)[O-])O)N)[N+](=O)[O-].[Na+]
InChi: InChI=1S/C18H14N6O8S.Cu.Na/c19-12-5-9(1-3-16(12)24(28)29)20-22-14-6-10(25)7-15(18(14)27)23-21-13-8-11(33(30,31)32)2-4-17(13)26;;/h1-8,25-27H,19H2,(H,30,31,32);;/q;+2;+1/p-3/b22-20+,23-21+;;
InChiKey: InChIKey=MICAYKISKHPKBN-RAZXBFMISA-K

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