Details
Stereochemistry | RACEMIC |
Molecular Formula | C16H15FN2O4.CH4O3S |
Molecular Weight | 414.405 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CC1COC2=C3N1C=C(C(O)=O)C(=O)C3=CC(F)=C2C4(N)CC4
InChI
InChIKey=UDHGFPATQWQARM-UHFFFAOYSA-N
InChI=1S/C16H15FN2O4.CH4O3S/c1-7-6-23-14-11(16(18)2-3-16)10(17)4-8-12(14)19(7)5-9(13(8)20)15(21)22;1-5(2,3)4/h4-5,7H,2-3,6,18H2,1H3,(H,21,22);1H3,(H,2,3,4)
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C16H15FN2O4 |
Molecular Weight | 318.2997 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:58:25 UTC 2023
by
admin
on
Sat Dec 16 19:58:25 UTC 2023
|
Record UNII |
K2T4E769Q9
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
44181914
Created by
admin on Sat Dec 16 19:58:25 UTC 2023 , Edited by admin on Sat Dec 16 19:58:25 UTC 2023
|
PRIMARY | |||
|
K2T4E769Q9
Created by
admin on Sat Dec 16 19:58:25 UTC 2023 , Edited by admin on Sat Dec 16 19:58:25 UTC 2023
|
PRIMARY | |||
|
136905-87-8
Created by
admin on Sat Dec 16 19:58:25 UTC 2023 , Edited by admin on Sat Dec 16 19:58:25 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
|