DIRECT RED 149

CAS No.
CCD No.
CCD00103907
Formula
C32 H23 N7 O8 S2 . 2 Na
MolWeight
743.687

Basic Information

Product Name: DIRECT RED 149
English Synonyms: DIRECT RED 149
MDL Number.: MFCD00230635
H bond acceptor: 15
H bond donor: 5
Smile: c1cc(cc(c1)/N=N/c2c(cc3cc(ccc3c2O)Nc4ccc5c(c4)cc(c(c5O)/N=N/c6cccc(c6)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]
InChi: InChI=1S/C32H25N7O8S2.2Na/c33-19-3-1-5-23(15-19)36-38-29-27(48(42,43)44)13-17-11-21(7-9-25(17)31(29)40)35-22-8-10-26-18(12-22)14-28(49(45,46)47)30(32(26)41)39-37-24-6-2-4-20(34)16-24;;/h1-16,35,40-41H,33-34H2,(H,42,43,44)(H,45,46,47);;/q;2*+1/p-2/b38-36+,39-37+;;
InChiKey: InChIKey=WOGRZDRPXGONFR-PYIFGEPISA-L

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