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Substance Name: 5-Allyl-5-(2-cyclopenten-1-yl)barbituric acid, compound with (R-(R*,S*))-alpha-(1-(methylamino)ethyl)benzenemethanol (1:1)
RN: 85567-52-8
InChIKey: RCBIKCQIGMRSPZ-CGUPRBNSSA-N

Molecular Formula

  • C12-H14-N2-O3.C10-H15-N-O

Molecular Weight

  • 399.4881
 
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Names and Synonyms

Synonym

  • EINECS 287-766-1

Systematic Name

  • 5-Allyl-5-(2-cyclopenten-1-yl)barbituric acid, compound with (R-(R*,S*))-alpha-(1-(methylamino)ethyl)benzenemethanol (1:1)

Registry Numbers

CAS Registry Number

  • 85567-52-8

System Generated Number

  • 0085567528

Molecular Formulas

Molecular Formula

  • C12-H14-N2-O3.C10-H15-N-O

Molecular Formula Fragments

  • C10-H15-N-O
  • C12-H14-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C12H14N2O3.C10H15NO/c1-2-7-12(8-5-3-4-6-8)9(15)13-11(17)14-10(12)16;1-8(11-2)10(12)9-6-4-3-5-7-9/h2-3,5,8H,1,4,6-7H2,(H2,13,14,15,16,17);3-8,10-12H,1-2H3/t;8-,10-/m.0/s1

InChIKey

RCBIKCQIGMRSPZ-CGUPRBNSSA-N

Smiles

CN[C@@H](C)[C@H](O)c1ccccc1.C=CCC2(C3CCC=C3)C(=O)NC(=O)NC2=O