Details
Stereochemistry | RACEMIC |
Molecular Formula | C16H17BrClN3O3.ClH |
Molecular Weight | 451.142 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.O[C@H]1CCCN[C@@H]1CC(=O)CN2C=NC3=CC(Br)=C(Cl)C=C3C2=O
InChI
InChIKey=XFFYBQUXAJOKAL-LIOBNPLQSA-N
InChI=1S/C16H17BrClN3O3.ClH/c17-11-6-13-10(5-12(11)18)16(24)21(8-20-13)7-9(22)4-14-15(23)2-1-3-19-14;/h5-6,8,14-15,19,23H,1-4,7H2;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 | C16H17BrClN3O3 |
Molecular Weight | 414.681 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:07:26 UTC 2023
by
admin
on
Sat Dec 16 19:07:26 UTC 2023
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Record UNII |
48NFA5XJV4
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Record Status |
Validated (UNII)
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Record Version |
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-
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1217623-74-9
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60196305
Created by
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DTXSID9046863
Created by
admin on Sat Dec 16 19:07:26 UTC 2023 , Edited by admin on Sat Dec 16 19:07:26 UTC 2023
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48NFA5XJV4
Created by
admin on Sat Dec 16 19:07:26 UTC 2023 , Edited by admin on Sat Dec 16 19:07:26 UTC 2023
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PRIMARY |
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