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Substance Name: 1,3-Benzodioxan-2-carboxylic acid, 7-chloro-4-methyl-4-phenyl-, methyl ester, (E)-
ID: DF35096000
InChIKey: HQPLKMWKZCOKOM-IRXDYDNUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H15-Cl-O4

Molecular Weight

  • 318.7545
 
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Names and Synonyms

Synonym

  • trans-7-Chloro-4-methyl-4-phenyl-1,3-benzodioxan-2-carboxylic acid methyl ester

Systematic Name

  • 1,3-Benzodioxan-2-carboxylic acid, 7-chloro-4-methyl-4-phenyl-, methyl ester, (E)-

Registry Numbers

ID Number

  • NIOSH/DF3509600

System Generated Number

  • DF35096000

Structure Descriptors

InChI

1S/C17H15ClO4/c1-17(11-6-4-3-5-7-11)13-10-12(18)8-9-14(13)21-16(22-17)15(19)20-2/h3-10,16H,1-2H3/t16-,17-/m0/s1

InChIKey

HQPLKMWKZCOKOM-IRXDYDNUSA-N

Smiles

COC(=O)[C@H]1Oc2ccc(Cl)cc2[C@@](C)(O1)c3ccccc3