Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H28NO2.I |
Molecular Weight | 453.357 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[I-].COC1=C(OC)C=C(CC[C@H]2CCC3=CC=CC=C3[N+]2(C)C)C=C1
InChI
InChIKey=XCEYBABIMKISOV-FERBBOLQSA-M
InChI=1S/C21H28NO2.HI/c1-22(2)18(13-11-17-7-5-6-8-19(17)22)12-9-16-10-14-20(23-3)21(15-16)24-4;/h5-8,10,14-15,18H,9,11-13H2,1-4H3;1H/q+1;/p-1/t18-;/m0./s1
Molecular Formula | HI |
Molecular Weight | 127.9124 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C21H28NO2 |
Molecular Weight | 326.4525 |
Charge | 1 |
Count |
|
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:49:34 GMT 2023
by
admin
on
Sat Dec 16 09:49:34 GMT 2023
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Record UNII |
67U2G21YOE
|
Record Status |
Validated (UNII)
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Record Version |
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-
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67U2G21YOE
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1025483-04-8
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m132
Created by
admin on Sat Dec 16 09:49:34 GMT 2023 , Edited by admin on Sat Dec 16 09:49:34 GMT 2023
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PRIMARY | Merck Index | ||
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90479194
Created by
admin on Sat Dec 16 09:49:34 GMT 2023 , Edited by admin on Sat Dec 16 09:49:34 GMT 2023
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