3-Iodo-4-[(2-methyl-1-oxopropyl)amino]benzoic acid

CAS Registry Number®

1131614-34-0
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CAS Name

3-Iodo-4-[(2-methyl-1-oxopropyl)amino]benzoic acid

Molecular Formula

C11H12INO3

Molecular Mass

333.12

Cite this Page

3-Iodo-4-[(2-methyl-1-oxopropyl)amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1131614-34-0 (retrieved 2024-09-07) (CAS RN: 1131614-34-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12INO3/c1-6(2)10(14)13-9-4-3-7(11(15)16)5-8(9)12/h3-6H,1-2H3,(H,13,14)(H,15,16)

InChIKey

InChIKey=KUPOHPBPZLWBSJ-UHFFFAOYSA-N

SMILES

N(C(C(C)C)=O)C1=C(I)C=C(C(O)=O)C=C1

Canonical SMILES

O=C(O)C1=CC=C(NC(=O)C(C)C)C(I)=C1

Other Names for this Substance

  • Benzoic acid, 3-iodo-4-[(2-methyl-1-oxopropyl)amino]-
  • 3-Iodo-4-[(2-methyl-1-oxopropyl)amino]benzoic acid