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Substance Name: (1)-2-((p-Anisyl)methyl)-1-benzyl-1,2,5,6-tetrahydro-3,4-dimethylpyridinium hydrogen oxalate
RN: 94107-36-5
InChIKey: VCMIRIQOAQFPDB-UHFFFAOYSA-N

Molecular Formula

  • C22-H27-N-O.C2-H2-O4

Molecular Weight

  • 411.4951
 
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Names and Synonyms

Synonym

  • EINECS 302-269-2

Systematic Name

  • (1)-2-((p-Anisyl)methyl)-1-benzyl-1,2,5,6-tetrahydro-3,4-dimethylpyridinium hydrogen oxalate

Registry Numbers

CAS Registry Number

  • 94107-36-5

System Generated Number

  • 0094107365

Molecular Formulas

Molecular Formula

  • C22-H27-N-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C22-H27-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO.C2H2O4/c1-17-13-14-23(16-20-7-5-4-6-8-20)22(18(17)2)15-19-9-11-21(24-3)12-10-19;3-1(4)2(5)6/h4-12,22H,13-16H2,1-3H3;(H,3,4)(H,5,6)

InChIKey

VCMIRIQOAQFPDB-UHFFFAOYSA-N

Smiles

CC1=C(C([NH+](CC1)Cc2ccccc2)Cc3ccc(cc3)OC)C.C(=O)(C(=O)[O-])O