3,4-Dihydro-4-[(4-methylphenyl)sulfonyl]-2H-1,4-benzoxazine-2-carboxylic acid

CAS Registry Number®

35017-55-1
No image available.

CAS Name

3,4-Dihydro-4-[(4-methylphenyl)sulfonyl]-2H-1,4-benzoxazine-2-carboxylic acid

Molecular Formula

C16H15NO5S

Molecular Mass

333.36

Cite this Page

3,4-Dihydro-4-[(4-methylphenyl)sulfonyl]-2H-1,4-benzoxazine-2-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35017-55-1 (retrieved 2024-08-19) (CAS RN: 35017-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    170-175 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C16H15NO5S/c1-11-6-8-12(9-7-11)23(20,21)17-10-15(16(18)19)22-14-5-3-2-4-13(14)17/h2-9,15H,10H2,1H3,(H,18,19)

InChIKey

InChIKey=JJRMIGUHWKZLMH-UHFFFAOYSA-N

SMILES

S(=O)(=O)(N1C=2C(OC(C(O)=O)C1)=CC=CC2)C3=CC=C(C)C=C3

Canonical SMILES

O=C(O)C1OC=2C=CC=CC2N(C1)S(=O)(=O)C3=CC=C(C=C3)C

Other Names for this Substance

  • 2H-1,4-Benzoxazine-2-carboxylic acid, 3,4-dihydro-4-[(4-methylphenyl)sulfonyl]-
  • 3,4-Dihydro-4-[(4-methylphenyl)sulfonyl]-2H-1,4-benzoxazine-2-carboxylic acid