Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H19N3.C4H4O4 |
Molecular Weight | 369.4143 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.[H][C@]12CN(C)CCN1C3=C(CN4C=CC=C24)C=CC=C3
InChI
InChIKey=JJTOHZLQMBVMPF-MLCLTIQSSA-N
InChI=1S/C16H19N3.C4H4O4/c1-17-9-10-19-14-6-3-2-5-13(14)11-18-8-4-7-15(18)16(19)12-17;5-3(6)1-2-4(7)8/h2-8,16H,9-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-;/m1./s1
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C16H19N3 |
Molecular Weight | 253.3422 |
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 09:42:54 GMT 2023
by
admin
on
Sat Dec 16 09:42:54 GMT 2023
|
Record UNII |
MW6LOG604N
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Common Name | English | ||
|
Systematic Name | English |
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
76969156
Created by
admin on Sat Dec 16 09:42:54 GMT 2023 , Edited by admin on Sat Dec 16 09:42:54 GMT 2023
|
PRIMARY | |||
|
MW6LOG604N
Created by
admin on Sat Dec 16 09:42:54 GMT 2023 , Edited by admin on Sat Dec 16 09:42:54 GMT 2023
|
PRIMARY | |||
|
81729-72-8
Created by
admin on Sat Dec 16 09:42:54 GMT 2023 , Edited by admin on Sat Dec 16 09:42:54 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
RACEMATE -> ENANTIOMER |