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Substance Name: Benzoic acid, m-(2-methyl-5-phenylpyrrol-1-yl)-, compd. with 2-dimethylaminoethanol (1:1)
ID: DH40743320
InChIKey: LDVMZEXZTKNEHB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-N-O2.C4-H11-N-O

Molecular Weight

  • 366.4584
 
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Names and Synonyms

Synonym

  • m-(2-Methyl-5-phenylpyrrol-1-yl)benzoic acid compd. with 2-dimethylaminoethanol (1:1)

Systematic Name

  • Benzoic acid, m-(2-methyl-5-phenylpyrrol-1-yl)-, compd. with 2-dimethylaminoethanol (1:1)

Registry Numbers

ID Number

  • NIOSH/DH4074332

System Generated Number

  • DH40743320

Molecular Formulas

Molecular Formula

  • C18-H15-N-O2.C4-H11-N-O

Molecular Formula Fragments

  • C18-H15-N-O2
  • C4-H11-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C18H15NO2.C4H11NO/c1-13-10-11-17(14-6-3-2-4-7-14)19(13)16-9-5-8-15(12-16)18(20)21;1-5(2)3-4-6/h2-12H,1H3,(H,20,21);6H,3-4H2,1-2H3

InChIKey

LDVMZEXZTKNEHB-UHFFFAOYSA-N

Smiles

CN(C)CCO.Cc1ccc(c2ccccc2)n1c3cccc(c3)C(=O)O