Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C16H23NO2.ClH |
| Molecular Weight | 297.82 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(C)OC(=O)[C@@H]([C@H]1CCCCN1)C2=CC=CC=C2
InChI
InChIKey=TXNBJXUTVCOVOH-CTHHTMFSSA-N
InChI=1S/C16H23NO2.ClH/c1-12(2)19-16(18)15(13-8-4-3-5-9-13)14-10-6-7-11-17-14;/h3-5,8-9,12,14-15,17H,6-7,10-11H2,1-2H3;1H/t14-,15-;/m1./s1
| 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 |
| Molecular Formula | C16H23NO2 |
| Molecular Weight | 261.3593 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 16:23:44 GMT 2025
by
admin
on
Tue Apr 01 16:23:44 GMT 2025
|
| Record UNII |
2S5EF2TC87
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| Record Status |
Validated (UNII)
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| Record Version |
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2S5EF2TC87
Created by
admin on Tue Apr 01 16:23:44 GMT 2025 , Edited by admin on Tue Apr 01 16:23:44 GMT 2025
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PRIMARY | |||
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137699629
Created by
admin on Tue Apr 01 16:23:44 GMT 2025 , Edited by admin on Tue Apr 01 16:23:44 GMT 2025
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PRIMARY | PUBCHEM | ||
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1262795-94-7
Created by
admin on Tue Apr 01 16:23:44 GMT 2025 , Edited by admin on Tue Apr 01 16:23:44 GMT 2025
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93148-45-9
Created by
admin on Tue Apr 01 16:23:44 GMT 2025 , Edited by admin on Tue Apr 01 16:23:44 GMT 2025
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NON-SPECIFIC STEREOCHEMISTRY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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