1,1-Dimethylethyl 3-[(1Z)-2-bromo-3-ethoxy-3-oxo-1-propen-1-yl]-2-phenyl-1H-indole-1-carboxylate

CAS Registry Number®

1017968-67-0

CAS Name

1,1-Dimethylethyl 3-[(1Z)-2-bromo-3-ethoxy-3-oxo-1-propen-1-yl]-2-phenyl-1H-indole-1-carboxylate

Molecular Formula

C24H24BrNO4

Molecular Mass

470.36

Cite this Page

1,1-Dimethylethyl 3-[(1Z)-2-bromo-3-ethoxy-3-oxo-1-propen-1-yl]-2-phenyl-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1017968-67-0 (retrieved 2024-11-08) (CAS RN: 1017968-67-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    115-118 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C24H24BrNO4/c1-5-29-22(27)19(25)15-18-17-13-9-10-14-20(17)26(23(28)30-24(2,3)4)21(18)16-11-7-6-8-12-16/h6-15H,5H2,1-4H3/b19-15-

InChIKey

InChIKey=XLTKHHKDDXXUSK-CYVLTUHYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C(=C(/C=C(/C(OCC)=O)\Br)C=2C1=CC=CC2)C3=CC=CC=C3

Canonical SMILES

O=C(OCC)C(Br)=CC=1C=2C=CC=CC2N(C(=O)OC(C)(C)C)C1C=3C=CC=CC3

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 3-[(1Z)-2-bromo-3-ethoxy-3-oxo-1-propen-1-yl]-2-phenyl-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3-[(1Z)-2-bromo-3-ethoxy-3-oxo-1-propen-1-yl]-2-phenyl-1H-indole-1-carboxylate

CAS INSIGHTSTM
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