2-[2-Hydroxy-3-[(4-methylphenyl)sulfonyl]propoxy]benzonitrile

CAS Registry Number®

478079-77-5
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CAS Name

2-[2-Hydroxy-3-[(4-methylphenyl)sulfonyl]propoxy]benzonitrile

Molecular Formula

C17H17NO4S

Molecular Mass

331.39

Cite this Page

2-[2-Hydroxy-3-[(4-methylphenyl)sulfonyl]propoxy]benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=478079-77-5 (retrieved 2024-08-04) (CAS RN: 478079-77-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H17NO4S/c1-13-6-8-16(9-7-13)23(20,21)12-15(19)11-22-17-5-3-2-4-14(17)10-18/h2-9,15,19H,11-12H2,1H3

InChIKey

InChIKey=NWPSVOQIUOUKSB-UHFFFAOYSA-N

SMILES

S(CC(COC1=C(C#N)C=CC=C1)O)(=O)(=O)C2=CC=C(C)C=C2

Canonical SMILES

N#CC=1C=CC=CC1OCC(O)CS(=O)(=O)C2=CC=C(C=C2)C

Other Names for this Substance

  • Benzonitrile, 2-[2-hydroxy-3-[(4-methylphenyl)sulfonyl]propoxy]-
  • 2-[2-Hydroxy-3-[(4-methylphenyl)sulfonyl]propoxy]benzonitrile