3′-(Methylsulfonyl)-5-nitro[1,1′-biphenyl]-3-carboxylic acid

CAS Registry Number®

1261913-10-3
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CAS Name

3′-(Methylsulfonyl)-5-nitro[1,1′-biphenyl]-3-carboxylic acid

Molecular Formula

C14H11NO6S

Molecular Mass

321.31

Cite this Page

3′-(Methylsulfonyl)-5-nitro[1,1′-biphenyl]-3-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1261913-10-3 (retrieved 2024-09-07) (CAS RN: 1261913-10-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H11NO6S/c1-22(20,21)13-4-2-3-9(8-13)10-5-11(14(16)17)7-12(6-10)15(18)19/h2-8H,1H3,(H,16,17)

InChIKey

InChIKey=HAICSSQILPAAHZ-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=C(C=C(N(=O)=O)C1)C2=CC(S(C)(=O)=O)=CC=C2

Canonical SMILES

O=C(O)C=1C=C(C=C(C1)N(=O)=O)C=2C=CC=C(C2)S(=O)(=O)C

Other Names for this Substance

  • [1,1′-Biphenyl]-3-carboxylic acid, 3′-(methylsulfonyl)-5-nitro-
  • 3′-(Methylsulfonyl)-5-nitro[1,1′-biphenyl]-3-carboxylic acid