ACID ORANGE 79

CAS No.
6470-37-7
CCD No.
CCD08035541
Formula
C34 H27 N5 O9 S2 . 2 Na
MolWeight
759.725

Basic Information

Product Name: ACID ORANGE 79
CAS: 6470-37-7
English Synonyms: ACID ORANGE 79
MDL Number.: MFCD00267010
H bond acceptor: 14
H bond donor: 3
Smile: Cc1cc(ccc1c2ccc(cc2C)/N=N/C(=C(\C)/O)/C(=O)Nc3ccccc3)/N=N/c4c(ccc5c4c(cc(c5)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]
InChi: InChI=1S/C34H29N5O9S2.2Na/c1-19-15-24(36-38-32(21(3)40)34(42)35-23-7-5-4-6-8-23)10-12-27(19)28-13-11-25(16-20(28)2)37-39-33-29(41)14-9-22-17-26(49(43,44)45)18-30(31(22)33)50(46,47)48;;/h4-18,40-41H,1-3H3,(H,35,42)(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b32-21+,38-36+,39-37+;;
InChiKey: InChIKey=OPDDXMUFXLITNR-YOKOKRNYSA-L

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