Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H16N2.C4H4O4 |
Molecular Weight | 304.341 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.CN(C)CCC1=CNC2=CC=CC=C12
InChI
InChIKey=OHMVTPSXVQQKPA-WLHGVMLRSA-N
InChI=1S/C12H16N2.C4H4O4/c1-14(2)8-7-10-9-13-12-6-4-3-5-11(10)12;5-3(6)1-2-4(7)8/h3-6,9,13H,7-8H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
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 | C12H16N2 |
Molecular Weight | 188.2688 |
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
Sat Dec 16 08:46:51 UTC 2023
by
admin
on
Sat Dec 16 08:46:51 UTC 2023
|
Record UNII |
EP5189LWFM
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID0048896
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EP5189LWFM
Created by
admin on Sat Dec 16 08:46:51 UTC 2023 , Edited by admin on Sat Dec 16 08:46:51 UTC 2023
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68677-26-9
Created by
admin on Sat Dec 16 08:46:51 UTC 2023 , Edited by admin on Sat Dec 16 08:46:51 UTC 2023
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60196335
Created by
admin on Sat Dec 16 08:46:51 UTC 2023 , Edited by admin on Sat Dec 16 08:46:51 UTC 2023
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300000047760
Created by
admin on Sat Dec 16 08:46:51 UTC 2023 , Edited by admin on Sat Dec 16 08:46:51 UTC 2023
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |