CI 22145

CAS No.
2429-70-1
CCD No.
CCD00196687
Formula
C32 H21 N5 O7 S2 . 3 Na
MolWeight
720.648

Basic Information

Product Name: CI 22145
CAS: 2429-70-1
English Synonyms: CONGO CORINTH ; CONGO CORINTH G ; CI 22145 ; ERIE GARNET B
MDL Number.: MFCD01112238
H bond acceptor: 12
H bond donor: 2
Smile: c1ccc2c(c1)c(cc(c2N)/N=N/c3ccc(cc3)c4ccc(cc4)/N=N/c5cc(c6ccccc6c5O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi: InChI=1S/C32H23N5O7S2.3Na/c33-31-25-7-3-1-5-23(25)29(45(39,40)41)17-27(31)36-34-21-13-9-19(10-14-21)20-11-15-22(16-12-20)35-37-28-18-30(46(42,43)44)24-6-2-4-8-26(24)32(28)38;;;/h1-18,38H,33H2,(H,39,40,41)(H,42,43,44);;;/q;3*+1/p-2/b36-34+,37-35+;;;
InChiKey: InChIKey=LINXALNGIHLJDX-OESBJFCKSA-L

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