Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H18ClNO3.ClH |
| Molecular Weight | 356.244 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CN1CCC2=C(Cl)C(O)=C(O)C=C2C(C1)C3=CC=C(O)C=C3
InChI
InChIKey=YJGGPTFGAQRAOX-UHFFFAOYSA-N
InChI=1S/C17H18ClNO3.ClH/c1-19-7-6-12-13(8-15(21)17(22)16(12)18)14(9-19)10-2-4-11(20)5-3-10;/h2-5,8,14,20-22H,6-7,9H2,1H3;1H
| 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 | C17H18ClNO3 |
| Molecular Weight | 319.783 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:46:08 GMT 2025
by
admin
on
Mon Mar 31 23:46:08 GMT 2025
|
| Record UNII |
CU3LKP1HM7
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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2724762-90-5
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135121345
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CU3LKP1HM7
Created by
admin on Mon Mar 31 23:46:08 GMT 2025 , Edited by admin on Mon Mar 31 23:46:08 GMT 2025
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1269469
Created by
admin on Mon Mar 31 23:46:08 GMT 2025 , Edited by admin on Mon Mar 31 23:46:08 GMT 2025
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| Related Record | Type | Details | ||
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PARENT -> IMPURITY |
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