N-[[1-(5-Fluoropentyl)-1H-indol-3-yl]carbonyl]-3-methyl-L-valine methyl ester

CAS Registry Number®

1971007-88-1

CAS Name

N-[[1-(5-Fluoropentyl)-1H-indol-3-yl]carbonyl]-3-methyl-L-valine methyl ester

Molecular Formula

C21H29FN2O3

Molecular Mass

376.46

Cite this Page

N-[[1-(5-Fluoropentyl)-1H-indol-3-yl]carbonyl]-3-methyl-L-valine methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1971007-88-1 (retrieved 2024-11-22) (CAS RN: 1971007-88-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82-84 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H29FN2O3/c1-21(2,3)18(20(26)27-4)23-19(25)16-14-24(13-9-5-8-12-22)17-11-7-6-10-15(16)17/h6-7,10-11,14,18H,5,8-9,12-13H2,1-4H3,(H,23,25)/t18-/m1/s1

InChIKey

InChIKey=CHSUEEBESACQDV-GOSISDBHSA-N

SMILES

C(N[C@H](C(OC)=O)[C@](C)(C)C)(=O)C=1C=2C(N(CCCCCF)C1)=CC=CC2

Canonical SMILES

O=C(OC)C(NC(=O)C1=CN(C=2C=CC=CC12)CCCCCF)C(C)(C)C

Other Names for this Substance

  • L-Valine, N-[[1-(5-fluoropentyl)-1H-indol-3-yl]carbonyl]-3-methyl-, methyl ester
  • N-[[1-(5-Fluoropentyl)-1H-indol-3-yl]carbonyl]-3-methyl-L-valine methyl ester