Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1)

CAS Registry Number®

133167-77-8

CAS Name

Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1)

Molecular Formula

C12H15NO6S.Na

Cite this Page

Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=133167-77-8 (retrieved 2025-01-31) (CAS RN: 133167-77-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15NO6S.Na/c1-7-4-9(13-12(15)5-8(2)14)10(19-3)6-11(7)20(16,17)18;/h4,6H,5H2,1-3H3,(H,13,15)(H,16,17,18);

InChIKey

InChIKey=BLXXIGHGYWSNIA-UHFFFAOYSA-N

SMILES

N(C(CC(C)=O)=O)C1=C(OC)C=C(S(=O)(=O)O)C(C)=C1.[Na]

Canonical SMILES

[Na].O=C(NC=1C=C(C(=CC1OC)S(=O)(=O)O)C)CC(=O)C

Other Names for this Substance

  • Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, sodium salt (1:1)
  • Benzenesulfonic acid, 4-[(1,3-dioxobutyl)amino]-5-methoxy-2-methyl-, monosodium salt