Details
Stereochemistry | RACEMIC |
Molecular Formula | C19H18F6N2O.H3O4P |
Molecular Weight | 502.3446 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.[H][C@@]1(CCCCN1)[C@H](O)C2=CC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F
InChI
InChIKey=YCAFBJQXADKUSD-SATBOSKTSA-N
InChI=1S/C19H18F6N2O.H3O4P/c20-18(21,22)13-6-4-11(5-7-13)15-9-12(10-16(27-15)19(23,24)25)17(28)14-3-1-2-8-26-14;1-5(2,3)4/h4-7,9-10,14,17,26,28H,1-3,8H2;(H3,1,2,3,4)/t14-,17-;/m1./s1
Approval Year
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C271
Created by
admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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CHEMBL1327821
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C75268
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admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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DTXSID60216589
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admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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47910
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W-43
Created by
admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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C023767
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admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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QX39IR9V1D
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admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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66364-74-7
Created by
admin on Fri Dec 15 17:18:33 GMT 2023 , Edited by admin on Fri Dec 15 17:18:33 GMT 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD