Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H25NO3.ClH |
| Molecular Weight | 327.846 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(C)(C)NC[C@@H](O)COC1=C2CCCC(=O)C2=CC=C1
InChI
InChIKey=DNTDOBSIBZKFCP-UTONKHPSSA-N
InChI=1S/C17H25NO3.ClH/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20;/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3;1H/t12-;/m1./s1
| Molecular Formula | C17H25NO3 |
| Molecular Weight | 291.3853 |
| 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
Mon Mar 31 18:06:55 GMT 2025
by
admin
on
Mon Mar 31 18:06:55 GMT 2025
|
| Record UNII |
2L31MJM4SE
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Common Name | English | ||
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Preferred Name | English | ||
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Systematic Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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6420066
Created by
admin on Mon Mar 31 18:06:55 GMT 2025 , Edited by admin on Mon Mar 31 18:06:55 GMT 2025
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PRIMARY | |||
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DTXSID90423567
Created by
admin on Mon Mar 31 18:06:55 GMT 2025 , Edited by admin on Mon Mar 31 18:06:55 GMT 2025
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PRIMARY | |||
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27867-05-6
Created by
admin on Mon Mar 31 18:06:55 GMT 2025 , Edited by admin on Mon Mar 31 18:06:55 GMT 2025
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PRIMARY | |||
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2L31MJM4SE
Created by
admin on Mon Mar 31 18:06:55 GMT 2025 , Edited by admin on Mon Mar 31 18:06:55 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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RACEMATE -> ENANTIOMER |