Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H18F3N3O3 |
| Molecular Weight | 417.3811 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H]1C[C@H](N)CN1C2=CC3=C(C=C2F)C(=O)C(=CN3C4=CC=C(F)C=C4F)C(O)=O
InChI
InChIKey=CQSCBORSOIETFL-JQWIXIFHSA-N
InChI=1S/C21H18F3N3O3/c1-10-4-12(25)8-26(10)19-7-18-13(6-16(19)24)20(28)14(21(29)30)9-27(18)17-3-2-11(22)5-15(17)23/h2-3,5-7,9-10,12H,4,8,25H2,1H3,(H,29,30)/t10-,12-/m0/s1
| Molecular Formula | C21H18F3N3O3 |
| Molecular Weight | 417.3811 |
| Charge | 0 |
| 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
Wed Apr 02 17:38:42 GMT 2025
by
admin
on
Wed Apr 02 17:38:42 GMT 2025
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| Record UNII |
2Z84YC8WWN
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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Systematic Name | English |
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468954
Created by
admin on Wed Apr 02 17:38:42 GMT 2025 , Edited by admin on Wed Apr 02 17:38:42 GMT 2025
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2Z84YC8WWN
Created by
admin on Wed Apr 02 17:38:42 GMT 2025 , Edited by admin on Wed Apr 02 17:38:42 GMT 2025
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121357-19-5
Created by
admin on Wed Apr 02 17:38:42 GMT 2025 , Edited by admin on Wed Apr 02 17:38:42 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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![Structure of 7-[(2S,4S)-4-amino-2-methylpyrrolidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid hydrochloride](/img/732ab732-2628-42fb-94c2-ee4a3254b6e9.svg "Structure of 7-[(2S,4S)-4-amino-2-methylpyrrolidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid hydrochloride")