1,3-Dimethyl 2-[2-amino-4-(methylsulfonyl)phenyl]propanedioate

CAS Registry Number®

1373232-81-5

CAS Name

1,3-Dimethyl 2-[2-amino-4-(methylsulfonyl)phenyl]propanedioate

Molecular Formula

C12H15NO6S

Molecular Mass

301.32

Cite this Page

1,3-Dimethyl 2-[2-amino-4-(methylsulfonyl)phenyl]propanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1373232-81-5 (retrieved 2024-11-28) (CAS RN: 1373232-81-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15NO6S/c1-18-11(14)10(12(15)19-2)8-5-4-7(6-9(8)13)20(3,16)17/h4-6,10H,13H2,1-3H3

InChIKey

InChIKey=ZKBQKTBLEZFORV-UHFFFAOYSA-N

SMILES

C(C(OC)=O)(C(OC)=O)C1=C(N)C=C(S(C)(=O)=O)C=C1

Canonical SMILES

O=C(OC)C(C(=O)OC)C1=CC=C(C=C1N)S(=O)(=O)C

Other Names for this Substance

  • Propanedioic acid, 2-[2-amino-4-(methylsulfonyl)phenyl]-, 1,3-dimethyl ester
  • 1,3-Dimethyl 2-[2-amino-4-(methylsulfonyl)phenyl]propanedioate

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