3-(Ethoxycarbonyl)-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-1-propanoic acid

CAS Registry Number®

879329-76-7

CAS Name

3-(Ethoxycarbonyl)-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-1-propanoic acid

Molecular Formula

C17H18FNO4

Molecular Mass

319.33

Cite this Page

3-(Ethoxycarbonyl)-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-1-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=879329-76-7 (retrieved 2024-11-23) (CAS RN: 879329-76-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    107-108 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H18FNO4/c1-3-23-17(22)14-10-15(12-4-6-13(18)7-5-12)19(11(14)2)9-8-16(20)21/h4-7,10H,3,8-9H2,1-2H3,(H,20,21)

InChIKey

InChIKey=QVZRTFYPSGMJNG-UHFFFAOYSA-N

SMILES

C(CC(O)=O)N1C(=CC(C(OCC)=O)=C1C)C2=CC=C(F)C=C2

Canonical SMILES

O=C(OCC)C=1C=C(C=2C=CC(F)=CC2)N(C1C)CCC(=O)O

Other Names for this Substance

  • 1H-Pyrrole-1-propanoic acid, 3-(ethoxycarbonyl)-5-(4-fluorophenyl)-2-methyl-
  • 3-(Ethoxycarbonyl)-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-1-propanoic acid

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