Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H25ClN2O5.ClH |
| Molecular Weight | 445.337 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCOC(=O)C1=C(COCCN)NC(C)=C([C@H]1C2=C(Cl)C=CC=C2)C(=O)OC
InChI
InChIKey=BSBOZVBRVBLCLO-UNTBIKODSA-N
InChI=1S/C20H25ClN2O5.ClH/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;/h5-8,17,23H,4,9-11,22H2,1-3H3;1H/t17-;/m1./s1
| Molecular Formula | C20H25ClN2O5 |
| Molecular Weight | 408.876 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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 10:53:38 GMT 2023
by
admin
on
Sat Dec 16 10:53:38 GMT 2023
|
| Record UNII |
9W58UJ73Z4
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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9W58UJ73Z4
Created by
admin on Sat Dec 16 10:53:38 GMT 2023 , Edited by admin on Sat Dec 16 10:53:38 GMT 2023
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112500513
Created by
admin on Sat Dec 16 10:53:38 GMT 2023 , Edited by admin on Sat Dec 16 10:53:38 GMT 2023
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1027337-86-5
Created by
admin on Sat Dec 16 10:53:38 GMT 2023 , Edited by admin on Sat Dec 16 10:53:38 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
