N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine ethyl ester

CAS Registry Number®

212322-56-0
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CAS Name

N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine ethyl ester

Molecular Formula

C18H22N4O3

Molecular Mass

342.39

Cite this Page

N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=212322-56-0 (retrieved 2024-04-29) (CAS RN: 212322-56-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    103-104 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H22N4O3/c1-3-25-17(23)9-11-22(16-6-4-5-10-21-16)18(24)13-7-8-15(20-2)14(19)12-13/h4-8,10,12,20H,3,9,11,19H2,1-2H3

InChIKey

InChIKey=PCPATNZTKBOKOY-UHFFFAOYSA-N

SMILES

N(C(=O)C1=CC(N)=C(NC)C=C1)(CCC(OCC)=O)C2=CC=CC=N2

Canonical SMILES

O=C(OCC)CCN(C1=NC=CC=C1)C(=O)C2=CC=C(NC)C(N)=C2

Other Names for this Substance

  • β-Alanine, N-[3-amino-4-(methylamino)benzoyl]-N-2-pyridinyl-, ethyl ester
  • N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine ethyl ester
  • Ethyl 3-[(3-amino-4-methylaminobenzoyl)-(pyridin-2-yl)-amino]propanoate
  • Ethyl 3-[3-amino-4-(methylamino)-N-(pyridin-2-yl)benzoylamino]propanoate
  • Ethyl 3-[[3-amino-4-(methylamino)benzoyl](pyridin-2-yl)amino]propionate

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Deleted or Replaced CAS Registry Numbers

2758118-10-2

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