Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H24NO2S.I |
| Molecular Weight | 445.358 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[I-].C[N+]3(CC[C@](O)(C1=CC=CS1)C2=CC=CC=C2)CCOCC3
InChI
InChIKey=IOFXEUZPIIUQAG-GMUIIQOCSA-M
InChI=1S/C18H24NO2S.HI/c1-19(11-13-21-14-12-19)10-9-18(20,17-8-5-15-22-17)16-6-3-2-4-7-16;/h2-8,15,20H,9-14H2,1H3;1H/q+1;/p-1/t18-;/m1./s1
| Molecular Formula | C18H23NO2S |
| Molecular Weight | 317.446 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | HI |
| Molecular Weight | 127.9124 |
| 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
Sat Dec 16 10:14:08 UTC 2023
by
admin
on
Sat Dec 16 10:14:08 UTC 2023
|
| Record UNII |
6PB68RD9LI
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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76968041
Created by
admin on Sat Dec 16 10:14:08 UTC 2023 , Edited by admin on Sat Dec 16 10:14:08 UTC 2023
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PRIMARY | |||
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6PB68RD9LI
Created by
admin on Sat Dec 16 10:14:08 UTC 2023 , Edited by admin on Sat Dec 16 10:14:08 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
