Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H14Cl4N2O.HNO3 |
| Molecular Weight | 479.141 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[N+]([O-])=O.ClC1=CC=C(CO[C@H](CN2C=CN=C2)C3=CC=C(Cl)C=C3Cl)C(Cl)=C1
InChI
InChIKey=MCCACAIVAXEFAL-GMUIIQOCSA-N
InChI=1S/C18H14Cl4N2O.HNO3/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22;2-1(3)4/h1-8,11,18H,9-10H2;(H,2,3,4)/t18-;/m1./s1
| Molecular Formula | C18H14Cl4N2O |
| Molecular Weight | 416.129 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | HNO3 |
| Molecular Weight | 63.0128 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:43:39 GMT 2025
by
admin
on
Mon Mar 31 23:43:39 GMT 2025
|
| Record UNII |
D9G39YVK90
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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D9G39YVK90
Created by
admin on Mon Mar 31 23:43:39 GMT 2025 , Edited by admin on Mon Mar 31 23:43:39 GMT 2025
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27656-15-1
Created by
admin on Mon Mar 31 23:43:39 GMT 2025 , Edited by admin on Mon Mar 31 23:43:39 GMT 2025
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24208700
Created by
admin on Mon Mar 31 23:43:39 GMT 2025 , Edited by admin on Mon Mar 31 23:43:39 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |