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

CAS Registry Number®

72152-62-6

CAS Name

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

Molecular Formula

C26H26N2O11S2.2Na

Cite this Page

Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-hydroxy-3-(sulfooxy)propoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, sodium salt (1:2).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=72152-62-6 (retrieved 2024-12-23) (CAS RN: 72152-62-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H26N2O11S2.2Na/c1-12-8-13(2)26(40(32,33)34)14(3)23(12)28-18-9-19(38-10-15(29)11-39-41(35,36)37)22(27)21-20(18)24(30)16-6-4-5-7-17(16)25(21)31;;/h4-9,15,28-29H,10-11,27H2,1-3H3,(H,32,33,34)(H,35,36,37);;

InChIKey

InChIKey=TUEVFQGYHBZNIJ-UHFFFAOYSA-N

SMILES

N(C1=C2C(C(=O)C=3C(C2=O)=CC=CC3)=C(N)C(OCC(COS(=O)(=O)O)O)=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(OCC(O)COS(=O)(=O)O)=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-hydroxy-3-(sulfooxy)propoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, sodium salt (1:2)
  • Benzenesulfonic acid, 3-[[4-amino-9,10-dihydro-3-[2-hydroxy-3-(sulfooxy)propoxy]-9,10-dioxo-1-anthracenyl]amino]-2,4,6-trimethyl-, disodium salt

CAS INSIGHTSTM
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