3-(4-Methylphenyl)-1-(phenylmethyl)-1H-pyrazole-4-carboxylic acid

CAS Registry Number®

956453-12-6
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CAS Name

3-(4-Methylphenyl)-1-(phenylmethyl)-1H-pyrazole-4-carboxylic acid

Molecular Formula

C18H16N2O2

Molecular Mass

292.33

Cite this Page

3-(4-Methylphenyl)-1-(phenylmethyl)-1H-pyrazole-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=956453-12-6 (retrieved 2024-09-07) (CAS RN: 956453-12-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H16N2O2/c1-13-7-9-15(10-8-13)17-16(18(21)22)12-20(19-17)11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,21,22)

InChIKey

InChIKey=LPXNEXTXAIVFDK-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C(=NN(CC2=CC=CC=C2)C1)C3=CC=C(C)C=C3

Canonical SMILES

O=C(O)C1=CN(N=C1C=2C=CC(=CC2)C)CC=3C=CC=CC3

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 3-(4-methylphenyl)-1-(phenylmethyl)-
  • 3-(4-Methylphenyl)-1-(phenylmethyl)-1H-pyrazole-4-carboxylic acid