![2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, disodium salt](https://newcny.com/wp-content/uploads/2025/02/83027-45-6.svg)
CAS Registry Number®
83027-45-6
CAS Name
2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, sodium salt (1:2)
Molecular Formula
C27H28N2O9S2.2Na
Other Names and Identifiers
InChI
InChI=1S/C27H28N2O9S2.2Na/c1-13(2)28-17-9-10-18(29-16-8-6-14(27(3,4)5)12-20(16)40(36,37)38)23-22(17)24(30)15-7-11-19(39(33,34)35)25(31)21(15)26(23)32;;/h6-13,28-29,31H,1-5H3,(H,33,34,35)(H,36,37,38);;
InChIKey
InChIKey=RCDWTEGJDCFEHE-UHFFFAOYSA-N
SMILES
N(C1=C2C(C(=O)C=3C(C2=O)=C(O)C(S(=O)(=O)O)=CC3)=C(NC(C)C)C=C1)C4=C(S(=O)(=O)O)C=C(C(C)(C)C)C=C4.[Na]
Canonical SMILES
[Na].O=C1C2=CC=C(C(O)=C2C(=O)C=3C(=CC=C(NC(C)C)C13)NC4=CC=C(C=C4S(=O)(=O)O)C(C)(C)C)S(=O)(=O)O
Other Names for this Substance
- 2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, sodium salt (1:2)
- 2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, disodium salt
