Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H16N2O.C2H2O4 |
Molecular Weight | 294.3031 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.CN(C)CCC1=CNC2=C1C=C(O)C=C2
InChI
InChIKey=DYESHNNFAFXIKV-UHFFFAOYSA-N
InChI=1S/C12H16N2O.C2H2O4/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12;3-1(4)2(5)6/h3-4,7-8,13,15H,5-6H2,1-2H3;(H,3,4)(H,5,6)
Molecular Formula | C12H16N2O |
Molecular Weight | 204.2682 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C2H2O4 |
Molecular Weight | 90.0349 |
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
Edited
Fri Dec 15 15:47:20 UTC 2023
by
admin
on
Fri Dec 15 15:47:20 UTC 2023
|
Record UNII |
4494BFP9LU
|
Record Status |
Validated (UNII)
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Record Version |
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-
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4494BFP9LU
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95093
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18078
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2963-79-3
Created by
admin on Fri Dec 15 15:47:20 UTC 2023 , Edited by admin on Fri Dec 15 15:47:20 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |