Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H14N2O2.ClH |
| Molecular Weight | 254.713 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC(=O)[C@H](N)CC1=CNC2=C1C=CC=C2
InChI
InChIKey=XNFNGGQRDXFYMM-HNCPQSOCSA-N
InChI=1S/C12H14N2O2.ClH/c1-16-12(15)10(13)6-8-7-14-11-5-3-2-4-9(8)11;/h2-5,7,10,14H,6,13H2,1H3;1H/t10-;/m1./s1
| Molecular Formula | C12H14N2O2 |
| Molecular Weight | 218.2518 |
| 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
Wed Apr 02 18:03:40 GMT 2025
by
admin
on
Wed Apr 02 18:03:40 GMT 2025
|
| Record UNII |
4AD8W26KPC
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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4AD8W26KPC
Created by
admin on Wed Apr 02 18:03:40 GMT 2025 , Edited by admin on Wed Apr 02 18:03:40 GMT 2025
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PRIMARY | |||
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14907-27-8
Created by
admin on Wed Apr 02 18:03:40 GMT 2025 , Edited by admin on Wed Apr 02 18:03:40 GMT 2025
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DTXSID90466232
Created by
admin on Wed Apr 02 18:03:40 GMT 2025 , Edited by admin on Wed Apr 02 18:03:40 GMT 2025
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11184387
Created by
admin on Wed Apr 02 18:03:40 GMT 2025 , Edited by admin on Wed Apr 02 18:03:40 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
RACEMATE -> ENANTIOMER |
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