Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C22H31NO3.ClH |
| Molecular Weight | 393.947 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)C2=CC=CC=C2
InChI
InChIKey=SWIJYDAEGSIQPZ-UHFFFAOYSA-N
InChI=1S/C22H31NO3.ClH/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20;/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3;1H
Approval Year
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29704
Created by
admin on Fri Dec 15 16:42:46 UTC 2023 , Edited by admin on Fri Dec 15 16:42:46 UTC 2023
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54251
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1508-65-2
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1485103
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C73597
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759108
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DTXSID3045356
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7856
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100000092169
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DBSALT000430
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216-139-7
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L9F3D9RENQ
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SUB03581MIG
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CHEMBL1231
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91505
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L9F3D9RENQ
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m8324
Created by
admin on Fri Dec 15 16:42:46 UTC 2023 , Edited by admin on Fri Dec 15 16:42:46 UTC 2023
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PRIMARY | Merck Index |
ACTIVE MOIETY
SUBSTANCE RECORD