Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H16ClNO3 |
| Molecular Weight | 305.756 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC1=CC=C(C=C1)[C@@H]2CNCCC3=C(Cl)C(O)=C(O)C=C23
InChI
InChIKey=TVURRHSHRRELCG-ZDUSSCGKSA-N
InChI=1S/C16H16ClNO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2/t13-/m0/s1
| Molecular Formula | C16H16ClNO3 |
| Molecular Weight | 305.756 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:12:30 UTC 2023
by
admin
on
Sat Dec 16 10:12:30 UTC 2023
|
| Record UNII |
97BT14C36A
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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85145-23-9
Created by
admin on Sat Dec 16 10:12:31 UTC 2023 , Edited by admin on Sat Dec 16 10:12:31 UTC 2023
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97BT14C36A
Created by
admin on Sat Dec 16 10:12:31 UTC 2023 , Edited by admin on Sat Dec 16 10:12:31 UTC 2023
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6603851
Created by
admin on Sat Dec 16 10:12:31 UTC 2023 , Edited by admin on Sat Dec 16 10:12:31 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
