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Substance Name: 2-Oxo-2H-1-benzopyran-3-carboxylic acid, compound with (R-(R*,S*))-2-(methylamino)-1-phenylpropanol (1:1)
RN: 53166-67-9
InChIKey: QKWOGZAIBLZHBU-UHFFFAOYSA-N

Molecular Formula

  • C10-H15-N-O.C10-H6-O4

Molecular Weight

  • 355.3879
 
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Names and Synonyms

Synonym

  • EINECS 258-405-5

Systematic Name

  • 2-Oxo-2H-1-benzopyran-3-carboxylic acid, compound with (R-(R*,S*))-2-(methylamino)-1-phenylpropanol (1:1)

Registry Numbers

CAS Registry Number

  • 53166-67-9

System Generated Number

  • 0053166679

Molecular Formulas

Molecular Formula

  • C10-H15-N-O.C10-H6-O4

Molecular Formula Fragments

  • C10-H15-N-O
  • C10-H6-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C10H15NO.C10H6O4/c1-8(11-2)10(12)9-6-4-3-5-7-9;11-9(12)7-5-6-3-1-2-4-8(6)14-10(7)13/h3-8,10-12H,1-2H3;1-5H,(H,11,12)

InChIKey

QKWOGZAIBLZHBU-UHFFFAOYSA-N

Smiles

CC(C(c1ccccc1)O)NC.c1ccc2c(c1)cc(c(=O)o2)C(=O)O