Details
Stereochemistry | RACEMIC |
Molecular Formula | C22H28N4O5.2ClH |
Molecular Weight | 501.403 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.CCN(CC)CC(O)CNC1=C2C=C(OC)C(OC)=CC2=NC3=CC(=CC=C13)[N+]([O-])=O
InChI
InChIKey=JJXKDLJAHRXDIX-UHFFFAOYSA-N
InChI=1S/C22H28N4O5.2ClH/c1-5-25(6-2)13-15(27)12-23-22-16-8-7-14(26(28)29)9-18(16)24-19-11-21(31-4)20(30-3)10-17(19)22;;/h7-11,15,27H,5-6,12-13H2,1-4H3,(H,23,24);2*1H
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C22H28N4O5 |
Molecular Weight | 428.4815 |
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 10:03:00 GMT 2023
by
admin
on
Sat Dec 16 10:03:00 GMT 2023
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Record UNII |
YQ75B0KI1E
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Record Status |
Validated (UNII)
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Record Version |
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-
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YQ75B0KI1E
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153466
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13003
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73972-50-6
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m372
Created by
admin on Sat Dec 16 10:03:00 GMT 2023 , Edited by admin on Sat Dec 16 10:03:00 GMT 2023
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PRIMARY | Merck Index |