Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C15H16N2O3 |
Molecular Weight | 272.2991 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)[C@@H]1CCC2=C1C=CC(OCCN3C=CN=C3)=C2
InChI
InChIKey=IRWWXLHSNMVHNY-CQSZACIVSA-N
InChI=1S/C15H16N2O3/c18-15(19)14-3-1-11-9-12(2-4-13(11)14)20-8-7-17-6-5-16-10-17/h2,4-6,9-10,14H,1,3,7-8H2,(H,18,19)/t14-/m1/s1
Molecular Formula | C15H16N2O3 |
Molecular Weight | 272.2991 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
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 11:06:21 GMT 2023
by
admin
on
Sat Dec 16 11:06:21 GMT 2023
|
Record UNII |
TXY3E5MFHS
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Record Status |
Validated (UNII)
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Record Version |
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-
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TXY3E5MFHS
Created by
admin on Sat Dec 16 11:06:21 GMT 2023 , Edited by admin on Sat Dec 16 11:06:21 GMT 2023
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76964329
Created by
admin on Sat Dec 16 11:06:21 GMT 2023 , Edited by admin on Sat Dec 16 11:06:21 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |