Details
Stereochemistry | ACHIRAL |
Molecular Formula | C17H21N5O.C4H4O4 |
Molecular Weight | 427.4537 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CC1=CC=C(CN2C(NC3CCNCC3)=NC4=C2N=CC=C4)O1
InChI
InChIKey=CIILAEPYXFBPRG-BTJKTKAUSA-N
InChI=1S/C17H21N5O.C4H4O4/c1-12-4-5-14(23-12)11-22-16-15(3-2-8-19-16)21-17(22)20-13-6-9-18-10-7-13;5-3(6)1-2-4(7)8/h2-5,8,13,18H,6-7,9-11H2,1H3,(H,20,21);1-2H,(H,5,6)(H,7,8)/b;2-1-
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 | C17H21N5O |
Molecular Weight | 311.3815 |
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
Fri Dec 15 15:58:20 GMT 2023
by
admin
on
Fri Dec 15 15:58:20 GMT 2023
|
Record UNII |
WAYB7MW5R0
|
Record Status |
Validated (UNII)
|
Record Version |
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-
Download
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Systematic Name | English |
Code System | Code | Type | Description | ||
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111922-05-5
Created by
admin on Fri Dec 15 15:58:20 GMT 2023 , Edited by admin on Fri Dec 15 15:58:20 GMT 2023
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PRIMARY | |||
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23623612
Created by
admin on Fri Dec 15 15:58:20 GMT 2023 , Edited by admin on Fri Dec 15 15:58:20 GMT 2023
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PRIMARY | |||
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WAYB7MW5R0
Created by
admin on Fri Dec 15 15:58:20 GMT 2023 , Edited by admin on Fri Dec 15 15:58:20 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |