Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H21FN2O.C2H2O4 |
Molecular Weight | 414.4268 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(O)=O.CN(C)CCC[C@@]1(OCC2=C1C=CC(=C2)C#N)C3=CC=C(F)C=C3
InChI
InChIKey=KTGRHKOEFSJQNS-VEIFNGETSA-N
InChI=1S/C20H21FN2O.C2H2O4/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20;3-1(4)2(5)6/h4-9,12H,3,10-11,14H2,1-2H3;(H,3,4)(H,5,6)/t20-;/m1./s1
Approval Year
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45038690
Created by
admin on Sat Dec 16 11:36:32 GMT 2023 , Edited by admin on Sat Dec 16 11:36:32 GMT 2023
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LQ4I38573N
Created by
admin on Sat Dec 16 11:36:32 GMT 2023 , Edited by admin on Sat Dec 16 11:36:32 GMT 2023
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219861-53-7
Created by
admin on Sat Dec 16 11:36:32 GMT 2023 , Edited by admin on Sat Dec 16 11:36:32 GMT 2023
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DTXSID00661872
Created by
admin on Sat Dec 16 11:36:32 GMT 2023 , Edited by admin on Sat Dec 16 11:36:32 GMT 2023
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1134142
Created by
admin on Sat Dec 16 11:36:32 GMT 2023 , Edited by admin on Sat Dec 16 11:36:32 GMT 2023
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PRIMARY |
SUBSTANCE RECORD