4′-[[5-[[[(1S)-1-(4-Bromophenyl)ethyl]amino]carbonyl]-2,3-dimethyl-1H-indol-1-yl]methyl][1,1′-biphenyl]-2-carboxylic acid

CAS Registry Number®

1338259-06-5
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CAS Name

4′-[[5-[[[(1S)-1-(4-Bromophenyl)ethyl]amino]carbonyl]-2,3-dimethyl-1H-indol-1-yl]methyl][1,1′-biphenyl]-2-carboxylic acid

Molecular Formula

C33H29BrN2O3

Molecular Mass

581.50

Cite this Page

4′-[[5-[[[(1S)-1-(4-Bromophenyl)ethyl]amino]carbonyl]-2,3-dimethyl-1H-indol-1-yl]methyl][1,1′-biphenyl]-2-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1338259-06-5 (retrieved 2024-07-25) (CAS RN: 1338259-06-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H29BrN2O3/c1-20-22(3)36(19-23-8-10-25(11-9-23)28-6-4-5-7-29(28)33(38)39)31-17-14-26(18-30(20)31)32(37)35-21(2)24-12-15-27(34)16-13-24/h4-18,21H,19H2,1-3H3,(H,35,37)(H,38,39)/t21-/m0/s1

InChIKey

InChIKey=HBMXDCXJXYASGW-NRFANRHFSA-N

SMILES

C(N1C=2C(=CC(C(N[C@@H](C)C3=CC=C(Br)C=C3)=O)=CC2)C(C)=C1C)C4=CC=C(C=C4)C5=C(C(O)=O)C=CC=C5

Canonical SMILES

O=C(O)C=1C=CC=CC1C=2C=CC(=CC2)CN3C=4C=CC(=CC4C(=C3C)C)C(=O)NC(C5=CC=C(Br)C=C5)C

Other Names for this Substance

  • [1,1′-Biphenyl]-2-carboxylic acid, 4′-[[5-[[[(1S)-1-(4-bromophenyl)ethyl]amino]carbonyl]-2,3-dimethyl-1H-indol-1-yl]methyl]-
  • 4′-[[5-[[[(1S)-1-(4-Bromophenyl)ethyl]amino]carbonyl]-2,3-dimethyl-1H-indol-1-yl]methyl][1,1′-biphenyl]-2-carboxylic acid
  • SR 1824