Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C28H21FN3O4.Na |
| Molecular Weight | 505.4722 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[O-]C(=O)[C@@H]1C[C@H]1C2=C(F)C=C(C=C2)C3=CC(=CC=C3)N4C=C(C(=O)NC5CC5)C(=O)C6=CC=CN=C46
InChI
InChIKey=KJLAICCEMQRZCH-UMIAIAFLSA-M
InChI=1S/C28H22FN3O4.Na/c29-24-12-16(6-9-19(24)21-13-22(21)28(35)36)15-3-1-4-18(11-15)32-14-23(27(34)31-17-7-8-17)25(33)20-5-2-10-30-26(20)32;/h1-6,9-12,14,17,21-22H,7-8,13H2,(H,31,34)(H,35,36);/q;+1/p-1/t21-,22+;/m0./s1
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C28H21FN3O4 |
| Molecular Weight | 482.4824 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:11:02 UTC 2023
by
admin
on
Fri Dec 15 16:11:02 UTC 2023
|
| Record UNII |
NJ8ZXH1888
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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23687341
Created by
admin on Fri Dec 15 16:11:02 UTC 2023 , Edited by admin on Fri Dec 15 16:11:02 UTC 2023
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934995-88-7
Created by
admin on Fri Dec 15 16:11:02 UTC 2023 , Edited by admin on Fri Dec 15 16:11:02 UTC 2023
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NJ8ZXH1888
Created by
admin on Fri Dec 15 16:11:02 UTC 2023 , Edited by admin on Fri Dec 15 16:11:02 UTC 2023
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PRIMARY |
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