Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H28N2O3.C4H4O4 |
| Molecular Weight | 436.4987 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.CCOC1=C(OCC)C=C(C=C1)C(CN=C2CCCN2C)OC
InChI
InChIKey=CLPGVGDRLLHAGS-WLHGVMLRSA-N
InChI=1S/C18H28N2O3.C4H4O4/c1-5-22-15-10-9-14(12-16(15)23-6-2)17(21-4)13-19-18-8-7-11-20(18)3;5-3(6)1-2-4(7)8/h9-10,12,17H,5-8,11,13H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
| Molecular Formula | C18H28N2O3 |
| Molecular Weight | 320.4265 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| 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
Fri Dec 15 15:15:35 GMT 2023
by
admin
on
Fri Dec 15 15:15:35 GMT 2023
|
| Record UNII |
2LL9U9511R
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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40665-49-4
Created by
admin on Fri Dec 15 15:15:35 GMT 2023 , Edited by admin on Fri Dec 15 15:15:35 GMT 2023
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2LL9U9511R
Created by
admin on Fri Dec 15 15:15:35 GMT 2023 , Edited by admin on Fri Dec 15 15:15:35 GMT 2023
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PRIMARY | |||
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91663263
Created by
admin on Fri Dec 15 15:15:35 GMT 2023 , Edited by admin on Fri Dec 15 15:15:35 GMT 2023
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PRIMARY |
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|---|---|---|---|---|
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
