5-Nitro-1-(phenylmethyl)-1H-indole-3-carboxaldehyde

CAS Registry Number®

300664-53-3
No image available.

CAS Name

5-Nitro-1-(phenylmethyl)-1H-indole-3-carboxaldehyde

Molecular Formula

C16H12N2O3

Molecular Mass

280.28

Cite this Page

5-Nitro-1-(phenylmethyl)-1H-indole-3-carboxaldehyde.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=300664-53-3 (retrieved 2024-09-09) (CAS RN: 300664-53-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    178-180 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H12N2O3/c19-11-13-10-17(9-12-4-2-1-3-5-12)16-7-6-14(18(20)21)8-15(13)16/h1-8,10-11H,9H2

InChIKey

InChIKey=SOPMEIKWKUESBL-UHFFFAOYSA-N

SMILES

C(=O)C=1C=2C(N(CC3=CC=CC=C3)C1)=CC=C(N(=O)=O)C2

Canonical SMILES

O=CC1=CN(C=2C=CC(=CC12)N(=O)=O)CC=3C=CC=CC3

Other Names for this Substance

  • 1H-Indole-3-carboxaldehyde, 5-nitro-1-(phenylmethyl)-
  • 5-Nitro-1-(phenylmethyl)-1H-indole-3-carboxaldehyde
  • 1-Benzyl-5-nitroindole-3-carbaldehyde
  • 1-Benzyl-5-nitro-1H-3-indolecarbaldehyde