Phenol, 4-(1,3-dithiolan-2-yl)-, 1-(3-nitrobenzoate)

CAS Registry Number®

298215-51-7

CAS Name

Phenol, 4-(1,3-dithiolan-2-yl)-, 1-(3-nitrobenzoate)

Molecular Formula

C16H13NO4S2

Molecular Mass

347.41

Cite this Page

Phenol, 4-(1,3-dithiolan-2-yl)-, 1-(3-nitrobenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=298215-51-7 (retrieved 2024-10-04) (CAS RN: 298215-51-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H13NO4S2/c18-15(12-2-1-3-13(10-12)17(19)20)21-14-6-4-11(5-7-14)16-22-8-9-23-16/h1-7,10,16H,8-9H2

InChIKey

InChIKey=SWCVPXKFSKTDNC-UHFFFAOYSA-N

SMILES

O(C(=O)C1=CC(N(=O)=O)=CC=C1)C2=CC=C(C=C2)C3SCCS3

Canonical SMILES

O=C(OC1=CC=C(C=C1)C2SCCS2)C3=CC=CC(=C3)N(=O)=O

Other Names for this Substance

  • Phenol, 4-(1,3-dithiolan-2-yl)-, 1-(3-nitrobenzoate)
  • Phenol, 4-(1,3-dithiolan-2-yl)-, 3-nitrobenzoate

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