Details
Stereochemistry | RACEMIC |
Molecular Formula | 2C12H16N2O.C4H4O4 |
Molecular Weight | 524.6086 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 2 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.NCC1CN(CC2=CC=CC=C2)C(=O)C1.NCC3CN(CC4=CC=CC=C4)C(=O)C3
InChI
InChIKey=LJHCLGIFHRYJFN-WXXKFALUSA-N
InChI=1S/2C12H16N2O.C4H4O4/c2*13-7-11-6-12(15)14(9-11)8-10-4-2-1-3-5-10;5-3(6)1-2-4(7)8/h2*1-5,11H,6-9,13H2;1-2H,(H,5,6)(H,7,8)/b;;2-1+
Molecular Formula | C12H16N2O |
Molecular Weight | 204.2682 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:05:46 UTC 2023
by
admin
on
Sat Dec 16 09:05:46 UTC 2023
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Record UNII |
3GPZ0A8OW9
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Record Status |
Validated (UNII)
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Record Version |
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-
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97205-35-1
Created by
admin on Sat Dec 16 09:05:46 UTC 2023 , Edited by admin on Sat Dec 16 09:05:46 UTC 2023
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6444388
Created by
admin on Sat Dec 16 09:05:46 UTC 2023 , Edited by admin on Sat Dec 16 09:05:46 UTC 2023
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m839
Created by
admin on Sat Dec 16 09:05:46 UTC 2023 , Edited by admin on Sat Dec 16 09:05:46 UTC 2023
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PRIMARY | Merck Index | ||
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3GPZ0A8OW9
Created by
admin on Sat Dec 16 09:05:46 UTC 2023 , Edited by admin on Sat Dec 16 09:05:46 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |