1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-(4-methylbenzenesulfonate), (2R,4R)-rel-

CAS Registry Number®

113770-65-3

CAS Name

1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-(4-methylbenzenesulfonate), (2R,4R)-rel-

Molecular Formula

C20H19Cl2N3O5S

Molecular Mass

484.35

Cite this Page

1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-(4-methylbenzenesulfonate), (2R,4R)-rel-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113770-65-3 (retrieved 2024-11-13) (CAS RN: 113770-65-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C20H19Cl2N3O5S/c1-14-2-5-17(6-3-14)31(26,27)29-10-16-9-28-20(30-16,11-25-13-23-12-24-25)18-7-4-15(21)8-19(18)22/h2-8,12-13,16H,9-11H2,1H3/t16-,20+/s2

InChIKey

InChIKey=USLNGHIZGCHFQQ-PBUWTLLYNA-N

SMILES

C([C@]1(O[C@@H](COS(=O)(=O)C2=CC=C(C)C=C2)CO1)C3=C(Cl)C=C(Cl)C=C3)N4C=NC=N4

Canonical SMILES

O=S(=O)(OCC1OC(OC1)(C2=CC=C(Cl)C=C2Cl)CN3N=CN=C3)C4=CC=C(C=C4)C

Other Names for this Substance

  • 1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-(4-methylbenzenesulfonate), (2R,4R)-rel-
  • 1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-methylbenzenesulfonate (ester), cis-(±)-
  • 1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-methylbenzenesulfonate (ester), (2R,4R)-rel-
  • 1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-, 4-methylbenzenesulfonate (ester), cis-

CAS INSIGHTSTM
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