Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-(2-methoxyethoxy)ethoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, sodium salt (1:1)

CAS Registry Number®

70179-77-0
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CAS Name

Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-(2-methoxyethoxy)ethoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, sodium salt (1:1)

Molecular Formula

C28H30N2O8S.Na

Cite this Page

Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-(2-methoxyethoxy)ethoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, sodium salt (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=70179-77-0 (retrieved 2024-09-20) (CAS RN: 70179-77-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H30N2O8S.Na/c1-15-13-16(2)28(39(33,34)35)17(3)25(15)30-20-14-21(38-12-11-37-10-9-36-4)24(29)23-22(20)26(31)18-7-5-6-8-19(18)27(23)32;/h5-8,13-14,30H,9-12,29H2,1-4H3,(H,33,34,35);

InChIKey

InChIKey=KFLUXWWXQKMHAL-UHFFFAOYSA-N

SMILES

N(C1=C2C(C(=O)C=3C(C2=O)=CC=CC3)=C(N)C(OCCOCCOC)=C1)C4=C(C)C(S(=O)(=O)O)=C(C)C=C4C.[Na]

Canonical SMILES

[Na].O=C1C=2C=CC=CC2C(=O)C=3C(=CC(OCCOCCOC)=C(N)C13)NC4=C(C=C(C(=C4C)S(=O)(=O)O)C)C

Other Names for this Substance

  • Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-(2-methoxyethoxy)ethoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, sodium salt (1:1)
  • Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-(2-methoxyethoxy)ethoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, monosodium salt