Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H21ClN2.C4H7NO3 |
| Molecular Weight | 417.929 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)NCC(O)=O.CN(C)CCC1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2
InChI
InChIKey=OSAUSAZZRQEEES-UHFFFAOYSA-N
InChI=1S/C18H21ClN2.C4H7NO3/c1-21(2)11-9-17-16-8-7-15(19)12-14(16)6-5-13-4-3-10-20-18(13)17;1-3(6)5-2-4(7)8/h3-4,7-8,10,12,17H,5-6,9,11H2,1-2H3;2H2,1H3,(H,5,6)(H,7,8)
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29578
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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| Code System | Code | Type | Description | ||
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0R3CE06X9W
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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167455
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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335506
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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CHEMBL1738982
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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23256-09-9
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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C97697
Created by
admin on Fri Dec 15 17:12:06 UTC 2023 , Edited by admin on Fri Dec 15 17:12:06 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD