Details
Stereochemistry | RACEMIC |
Molecular Formula | C16H18N2O2.HNO3 |
Molecular Weight | 333.3392 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[N+]([O-])=O.CCOC(=O)C1=CN=CN1C2CCCC3=C2C=CC=C3
InChI
InChIKey=UOEKCNNIZWEMHG-UHFFFAOYSA-N
InChI=1S/C16H18N2O2.HNO3/c1-2-20-16(19)15-10-17-11-18(15)14-9-5-7-12-6-3-4-8-13(12)14;2-1(3)4/h3-4,6,8,10-11,14H,2,5,7,9H2,1H3;(H,2,3,4)
Molecular Formula | C16H18N2O2 |
Molecular Weight | 270.3263 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
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
Fri Dec 15 15:28:38 GMT 2023
by
admin
on
Fri Dec 15 15:28:38 GMT 2023
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Record UNII |
OT5Z8RA5RQ
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C514
Created by
admin on Fri Dec 15 15:28:38 GMT 2023 , Edited by admin on Fri Dec 15 15:28:38 GMT 2023
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DTXSID60933921
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PRIMARY | |||
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C72962
Created by
admin on Fri Dec 15 15:28:38 GMT 2023 , Edited by admin on Fri Dec 15 15:28:38 GMT 2023
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CHEMBL2110611
Created by
admin on Fri Dec 15 15:28:38 GMT 2023 , Edited by admin on Fri Dec 15 15:28:38 GMT 2023
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PRIMARY | |||
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15037-55-5
Created by
admin on Fri Dec 15 15:28:38 GMT 2023 , Edited by admin on Fri Dec 15 15:28:38 GMT 2023
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PRIMARY | |||
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27006
Created by
admin on Fri Dec 15 15:28:38 GMT 2023 , Edited by admin on Fri Dec 15 15:28:38 GMT 2023
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PRIMARY | |||
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OT5Z8RA5RQ
Created by
admin on Fri Dec 15 15:28:38 GMT 2023 , Edited by admin on Fri Dec 15 15:28:38 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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ENANTIOMER -> RACEMATE | |||
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PARENT -> SALT/SOLVATE | |||
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ENANTIOMER -> RACEMATE |