1,3-Diethyl 2-(acetylamino)-2-[(2-nitrophenyl)methyl]propanedioate

CAS Registry Number®

6960-47-0

CAS Name

1,3-Diethyl 2-(acetylamino)-2-[(2-nitrophenyl)methyl]propanedioate

Molecular Formula

C16H20N2O7

Molecular Mass

352.34

Cite this Page

1,3-Diethyl 2-(acetylamino)-2-[(2-nitrophenyl)methyl]propanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6960-47-0 (retrieved 2024-12-19) (CAS RN: 6960-47-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    106 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H20N2O7/c1-4-24-14(20)16(17-11(3)19,15(21)25-5-2)10-12-8-6-7-9-13(12)18(22)23/h6-9H,4-5,10H2,1-3H3,(H,17,19)

InChIKey

InChIKey=YITKHGMBUGYMPM-UHFFFAOYSA-N

SMILES

C(CC1=C(N(=O)=O)C=CC=C1)(C(OCC)=O)(C(OCC)=O)NC(C)=O

Canonical SMILES

O=C(OCC)C(NC(=O)C)(C(=O)OCC)CC=1C=CC=CC1N(=O)=O

Other Names for this Substance

  • Propanedioic acid, 2-(acetylamino)-2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester
  • Malonic acid, acetamido(o-nitrobenzyl)-, diethyl ester
  • Propanedioic acid, (acetylamino)[(2-nitrophenyl)methyl]-, diethyl ester
  • 1,3-Diethyl 2-(acetylamino)-2-[(2-nitrophenyl)methyl]propanedioate
  • NSC 69880

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