Details
Stereochemistry | RACEMIC |
Molecular Formula | C17H20NO3.Na |
Molecular Weight | 309.3354 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CCC1=CC=CC2=C1NC3=C2CCOC3(CC)CC([O-])=O
InChI
InChIKey=OYVVSFKYBAVZJZ-UHFFFAOYSA-M
InChI=1S/C17H21NO3.Na/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12;/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20);/q;+1/p-1
Molecular Formula | C17H20NO3 |
Molecular Weight | 286.3456 |
Charge | -1 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:54:21 UTC 2023
by
admin
on
Sat Dec 16 01:54:21 UTC 2023
|
Record UNII |
VIQ282YI0V
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID50911859
Created by
admin on Sat Dec 16 01:54:21 UTC 2023 , Edited by admin on Sat Dec 16 01:54:21 UTC 2023
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136067-30-6
Created by
admin on Sat Dec 16 01:54:21 UTC 2023 , Edited by admin on Sat Dec 16 01:54:21 UTC 2023
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SUPERSEDED | |||
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23665895
Created by
admin on Sat Dec 16 01:54:21 UTC 2023 , Edited by admin on Sat Dec 16 01:54:21 UTC 2023
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110781-63-0
Created by
admin on Sat Dec 16 01:54:21 UTC 2023 , Edited by admin on Sat Dec 16 01:54:21 UTC 2023
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VIQ282YI0V
Created by
admin on Sat Dec 16 01:54:21 UTC 2023 , Edited by admin on Sat Dec 16 01:54:21 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE | |||
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PARENT -> SALT/SOLVATE |