Details
Stereochemistry | ACHIRAL |
Molecular Formula | C26H25N5O2.C4H4O4 |
Molecular Weight | 555.5823 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 2 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C#Cc1cccc(c1)N=c2c(C#N)c[nH]c3cc(c(cc32)N=C(/C(/[H])=C(\[H])/CN(C)C)O)OCC.C(\[H])(=C(\[H])/C(=O)O)/C(=O)O
InChI
InChIKey=AXQMBLZSKCUMJL-CNEOMQSYSA-N
InChI=1S/C26H25N5O2.C4H4O4/c1-5-18-9-7-10-20(13-18)29-26-19(16-27)17-28-22-15-24(33-6-2)23(14-21(22)26)30-25(32)11-8-12-31(3)4;5-3(6)1-2-4(7)8/h1,7-11,13-15,17H,6,12H2,2-4H3,(H,28,29)(H,30,32);1-2H,(H,5,6)(H,7,8)/b11-8+;2-1-
Molecular Formula | C26H25N5O2 |
Molecular Weight | 439.51 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0723 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Jun 25 21:26:39 UTC 2021
by
admin
on
Fri Jun 25 21:26:39 UTC 2021
|
Record UNII |
KEV8HMY439
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Systematic Name | English |
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KEV8HMY439
Created by
admin on Fri Jun 25 21:26:39 UTC 2021 , Edited by admin on Fri Jun 25 21:26:39 UTC 2021
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1701408-75-4
Created by
admin on Fri Jun 25 21:26:39 UTC 2021 , Edited by admin on Fri Jun 25 21:26:39 UTC 2021
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PRIMARY |
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ACTIVE MOIETY |