sodium 3-[[[4-[(E)-[4-[(4-ethoxyphenyl)amino]phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]-2-methyl-1-cyclohexa-2,5-dienylidene]methyl]-3-methyl-phenyl]-ethyl-amino]methyl]benzenesulfonate
Molecular Formula:
C47H48N3NaO7S2
InChI: InChI=1/C47H49N3O7S2.Na/c1-6-49(31-35-11-9-13-43(29-35)58(51,52)53)40-21-25-45(33(4)27-40)47(37-15-17-38(18-16-37)48-39-19-23-42(24-20-39)57-8-3)46-26-22-41(28-34(46)5)50(7-2)32-36-12-10-14-44(30-36)59(54,55)56;/h9-30H,6-8,31-32H2,1-5H3,(H2,51,52,53,54,55,56);/q;+1/p-1/fC47H48N3O7S2.Na/h48H;/q-1;m
InChIKey: InChIKey=RWVGQQGBQSJDQV-HGLCSMBLCD
SMILES: CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC(=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3C)C5=CC=C(C=C5)NC6=CC=C(C=C6)OCC)C.[Na+]
Names:
sodium 3-[[[4-[(E)-[4-[(4-ethoxyphenyl)amino]phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]-2-methyl-1-cyclohexa-2,5-dienylidene]methyl]-3-methyl-phenyl]-ethyl-amino]methyl]benzenesulfonate
Registries:
PubChem CID 6328534
PubChem ID 11600125
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