4-[(2-Methyl-1-oxopropyl)amino]benzenepropanoic acid

CAS Registry Number®

895979-98-3
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CAS Name

4-[(2-Methyl-1-oxopropyl)amino]benzenepropanoic acid

Molecular Formula

C13H17NO3

Molecular Mass

235.28

Cite this Page

4-[(2-Methyl-1-oxopropyl)amino]benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=895979-98-3 (retrieved 2024-08-13) (CAS RN: 895979-98-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H17NO3/c1-9(2)13(17)14-11-6-3-10(4-7-11)5-8-12(15)16/h3-4,6-7,9H,5,8H2,1-2H3,(H,14,17)(H,15,16)

InChIKey

InChIKey=XEELXERBOYUNPA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CCC1=CC=C(C=C1)NC(=O)C(C)C

Other Names for this Substance

  • Benzenepropanoic acid, 4-[(2-methyl-1-oxopropyl)amino]-
  • 4-[(2-Methyl-1-oxopropyl)amino]benzenepropanoic acid