CAS:83006-69-3 2-Anthracenesulfonic acid, 5,8-bis[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, trisodium salt China Chemical

2-Anthracenesulfonic acid, 5,8-bis[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, trisodium salt

CAS:83006-69-3

SKU： NCC.83006.69.3 分类： Study Chemistry

保证安全结账

CAS Registry Number^®

83006-69-3

CAS Name

2-Anthracenesulfonic acid, 5,8-bis[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, sodium salt (1:3)

Molecular Formula

C₃₄H₃₄N₂O₁₃S₃.3Na

Other Names and Identifiers

InChI

InChI=1S/C34H34N2O13S3.3Na/c1-33(2,3)16-7-9-18(23(13-16)50(41,42)43)35-20-11-12-21(36-19-10-8-17(34(4,5)6)14-24(19)51(44,45)46)27-26(20)31(39)28-22(37)15-25(52(47,48)49)30(38)29(28)32(27)40;;;/h7-15,35-38H,1-6H3,(H,41,42,43)(H,44,45,46)(H,47,48,49);;;

InChIKey

InChIKey=SEMJEOYHBBUWRV-UHFFFAOYSA-N

SMILES

N(C1=C2C(=C(NC3=C(S(=O)(=O)O)C=C(C(C)(C)C)C=C3)C=C1)C(=O)C=4C(C2=O)=C(O)C(S(=O)(=O)O)=CC4O)C5=C(S(=O)(=O)O)C=C(C(C)(C)C)C=C5.[Na]

Canonical SMILES

[Na].O=C1C2=C(O)C=C(C(O)=C2C(=O)C=3C(=CC=C(NC4=CC=C(C=C4S(=O)(=O)O)C(C)(C)C)C13)NC5=CC=C(C=C5S(=O)(=O)O)C(C)(C)C)S(=O)(=O)O

Other Names for this Substance

2-Anthracenesulfonic acid, 5,8-bis[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, sodium salt (1:3)
2-Anthracenesulfonic acid, 5,8-bis[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1,4-dihydroxy-9,10-dioxo-, trisodium salt