Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H17N3.C4H4O4 |
| Molecular Weight | 367.3984 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CCCN(N1C=CC2=C1C=CC=C2)C3=CC=NC=C3
InChI
InChIKey=KKPNPFIUMDXTTA-BTJKTKAUSA-N
InChI=1S/C16H17N3.C4H4O4/c1-2-12-18(15-7-10-17-11-8-15)19-13-9-14-5-3-4-6-16(14)19;5-3(6)1-2-4(7)8/h3-11,13H,2,12H2,1H3;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 | C16H17N3 |
| Molecular Weight | 251.3263 |
| 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 09:55:28 GMT 2023
by
admin
on
Sat Dec 16 09:55:28 GMT 2023
|
| Record UNII |
D6F22D30R9
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
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D6F22D30R9
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admin on Sat Dec 16 09:55:28 GMT 2023 , Edited by admin on Sat Dec 16 09:55:28 GMT 2023
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119257-40-8
Created by
admin on Sat Dec 16 09:55:28 GMT 2023 , Edited by admin on Sat Dec 16 09:55:28 GMT 2023
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m1024
Created by
admin on Sat Dec 16 09:55:28 GMT 2023 , Edited by admin on Sat Dec 16 09:55:28 GMT 2023
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PRIMARY | Merck Index | ||
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9885551
Created by
admin on Sat Dec 16 09:55:28 GMT 2023 , Edited by admin on Sat Dec 16 09:55:28 GMT 2023
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PRIMARY |