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Substance Name: 3-(Ethoxycarbonylmethylthio)benzanthrone
RN: 69658-14-6
InChIKey: MIFRQFLBTQFDII-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C21-H16-O3-S

Molecular Weight

  • 348.42
 
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Names and Synonyms

Results Name

  • 3-(Ethoxycarbonylmethylthio)benzanthrone

Synonyms

  • ((7-Oxo-7H-benz(de)anthracen-3-yl)thio)acetic acid ethyl ester
  • 2-08-00-00242 (Beilstein Handbook Reference)
  • 3-(Ethoxycarbonylmethylthio)benzanthrone
  • 3-Benzanthronyl carbethoxymethyl sulfide
  • BRN 3442658

Systematic Name

  • Acetic acid, ((7-oxo-7H-benz(de)anthracen-3-yl)thio)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 69658-14-6

System Generated Number

  • 0069658146

Structure Descriptors

InChI

1S/C21H16O3S/c1-2-24-19(22)12-25-18-11-10-14-13-6-3-4-7-15(13)21(23)17-9-5-8-16(18)20(14)17/h3-11H,2,12H2,1H3

InChIKey

MIFRQFLBTQFDII-UHFFFAOYSA-N

Smiles

c12c3c4c(cccc4)C(c2cccc1c(SCC(OCC)=O)cc3)=O