3-Nitro-2-(1-pyrrolidinyl)benzoic acid

CAS Registry Number®

890091-65-3
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CAS Name

3-Nitro-2-(1-pyrrolidinyl)benzoic acid

Molecular Formula

C11H12N2O4

Molecular Mass

236.22

Cite this Page

3-Nitro-2-(1-pyrrolidinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=890091-65-3 (retrieved 2024-08-23) (CAS RN: 890091-65-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12N2O4/c14-11(15)8-4-3-5-9(13(16)17)10(8)12-6-1-2-7-12/h3-5H,1-2,6-7H2,(H,14,15)

InChIKey

InChIKey=TZXHPSXCEZFUID-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C(N(=O)=O)=CC=C1)N2CCCC2

Canonical SMILES

O=C(O)C1=CC=CC(=C1N2CCCC2)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 3-nitro-2-(1-pyrrolidinyl)-
  • 3-Nitro-2-(1-pyrrolidinyl)benzoic acid

Deleted or Replaced CAS Registry Numbers

1185095-10-6, 2665655-59-2