Methyl 3-[(1E)-2-(dimethylamino)ethenyl]-2-nitrobenzoate

CAS Registry Number®

68109-89-7

CAS Name

Methyl 3-[(1E)-2-(dimethylamino)ethenyl]-2-nitrobenzoate

Molecular Formula

C12H14N2O4

Molecular Mass

250.25

Cite this Page

Methyl 3-[(1E)-2-(dimethylamino)ethenyl]-2-nitrobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68109-89-7 (retrieved 2024-11-29) (CAS RN: 68109-89-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14N2O4/c1-13(2)8-7-9-5-4-6-10(12(15)18-3)11(9)14(16)17/h4-8H,1-3H3/b8-7+

InChIKey

InChIKey=PPCHVJGFXSDKDO-BQYQJAHWSA-N

SMILES

N(=O)(=O)C1=C(C(OC)=O)C=CC=C1/C=C/N(C)C

Canonical SMILES

O=C(OC)C=1C=CC=C(C=CN(C)C)C1N(=O)=O

Other Names for this Substance

  • Benzoic acid, 3-[(1E)-2-(dimethylamino)ethenyl]-2-nitro-, methyl ester
  • Benzoic acid, 3-[2-(dimethylamino)ethenyl]-2-nitro-, methyl ester, (E)-
  • Methyl 3-[(1E)-2-(dimethylamino)ethenyl]-2-nitrobenzoate
  • 3-((E)-2-Dimethylaminoethenyl)-2-nitrobenzoic acid methyl ester

CAS INSIGHTSTM
Hourglass and a clock