Details
Stereochemistry | RACEMIC |
Molecular Formula | C20H19FN2O2.C2H2O4 |
Molecular Weight | 428.4103 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.CN(C)CCCC1(OC(=O)C2=C1C=CC(=C2)C#N)C3=CC=C(F)C=C3
InChI
InChIKey=OOOSHXRAOKIVNG-UHFFFAOYSA-N
InChI=1S/C20H19FN2O2.C2H2O4/c1-23(2)11-3-10-20(15-5-7-16(21)8-6-15)18-9-4-14(13-22)12-17(18)19(24)25-20;3-1(4)2(5)6/h4-9,12H,3,10-11H2,1-2H3;(H,3,4)(H,5,6)
Approval Year
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Code System | Code | Type | Description | ||
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MJH9W62EFS
Created by
admin on Sat Dec 16 18:32:32 GMT 2023 , Edited by admin on Sat Dec 16 18:32:32 GMT 2023
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PRIMARY | |||
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129318459
Created by
admin on Sat Dec 16 18:32:32 GMT 2023 , Edited by admin on Sat Dec 16 18:32:32 GMT 2023
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1440961-11-4
Created by
admin on Sat Dec 16 18:32:32 GMT 2023 , Edited by admin on Sat Dec 16 18:32:32 GMT 2023
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PRIMARY |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD