trisodium 1-amino-4-[[4-[[4-chloro-6-[(2-sulfonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-3-sulfonato-phenyl]amino]-9,10-dioxo-anthracene-2-sulfonate
Molecular Formula:
C29H17ClN7Na3O11S3
InChI: InChI=1/C29H20ClN7O11S3.3Na/c30-27-35-28(33-16-7-3-4-8-19(16)49(40,41)42)37-29(36-27)34-17-10-9-13(11-20(17)50(43,44)45)32-18-12-21(51(46,47)48)24(31)23-22(18)25(38)14-5-1-2-6-15(14)26(23)39;;;/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37);;;/q;3*+1/p-3/fC29H17ClN7O11S3.3Na/h33-34H;;;/q-3;3m
InChIKey: InChIKey=KIRKGWILHWJIMS-QRLOFKIYCW
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]
Names:
trisodium 1-amino-4-[[4-[[4-chloro-6-[(2-sulfonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-3-sulfonato-phenyl]amino]-9,10-dioxo-anthracene-2-sulfonate
Registries:
PubChem CID 172468
PubChem ID 10257778
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