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Details

Stereochemistry ACHIRAL
Molecular Formula C10H11N3.C4H4O4
Molecular Weight 289.2866
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-METHYLIMIDAZOL-1-YLMETHYL)PYRIDINE FUMARATE

SMILES

OC(=O)\C=C\C(O)=O.CC1=NC=CN1CC2=CC=CC=N2

InChI

InChIKey=VXGHNCAEIMCDOR-WLHGVMLRSA-N
InChI=1S/C10H11N3.C4H4O4/c1-9-11-6-7-13(9)8-10-4-2-3-5-12-10;5-3(6)1-2-4(7)8/h2-7H,8H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

HIDE SMILES / InChI

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C10H11N3
Molecular Weight 173.2144
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 16 18:39:26 UTC 2022
Edited
by admin
on Fri Dec 16 18:39:26 UTC 2022
Record UNII
F011PM3JM0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2-METHYLIMIDAZOL-1-YLMETHYL)PYRIDINE FUMARATE
Systematic Name English
NDD-094 FUMARATE
Code English
PYRIDINE, 2-((2-METHYL-1H-IMIDAZOL-1-YL)METHYL)-, (2E)-2-BUTENEDIOATE (1:1)
Systematic Name English
Code System Code Type Description
CAS
862156-56-7
Created by admin on Fri Dec 16 18:39:26 UTC 2022 , Edited by admin on Fri Dec 16 18:39:26 UTC 2022
NON-SPECIFIC STOICHIOMETRY
FDA UNII
F011PM3JM0
Created by admin on Fri Dec 16 18:39:26 UTC 2022 , Edited by admin on Fri Dec 16 18:39:26 UTC 2022
PRIMARY
PUBCHEM
16095350
Created by admin on Fri Dec 16 18:39:26 UTC 2022 , Edited by admin on Fri Dec 16 18:39:26 UTC 2022
PRIMARY
CAS
946148-85-2
Created by admin on Fri Dec 16 18:39:26 UTC 2022 , Edited by admin on Fri Dec 16 18:39:26 UTC 2022
PRIMARY
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