5-(Ethylsulfonyl)-2-methoxy-4-nitrobenzoic acid

CAS Registry Number®

79893-22-4

CAS Name

5-(Ethylsulfonyl)-2-methoxy-4-nitrobenzoic acid

Molecular Formula

C10H11NO7S

Molecular Mass

289.26

Cite this Page

5-(Ethylsulfonyl)-2-methoxy-4-nitrobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79893-22-4 (retrieved 2024-10-07) (CAS RN: 79893-22-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H11NO7S/c1-3-19(16,17)9-4-6(10(12)13)8(18-2)5-7(9)11(14)15/h4-5H,3H2,1-2H3,(H,12,13)

InChIKey

InChIKey=NCMKWHOWUUZOFU-UHFFFAOYSA-N

SMILES

S(CC)(=O)(=O)C1=C(N(=O)=O)C=C(OC)C(C(O)=O)=C1

Canonical SMILES

O=C(O)C=1C=C(C(=CC1OC)N(=O)=O)S(=O)(=O)CC

Other Names for this Substance

  • Benzoic acid, 5-(ethylsulfonyl)-2-methoxy-4-nitro-
  • 5-(Ethylsulfonyl)-2-methoxy-4-nitrobenzoic acid

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