Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C20H25N3O5.ClH.2H2O |
| Molecular Weight | 459.921 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.Cl.COC1=C(OC)C=C(CCNCCCNC(=O)C2=CC=C(C=C2)[N+]([O-])=O)C=C1
InChI
InChIKey=GRWRRGVCHCBBLK-UHFFFAOYSA-N
InChI=1S/C20H25N3O5.ClH.2H2O/c1-27-18-9-4-15(14-19(18)28-2)10-13-21-11-3-12-22-20(24)16-5-7-17(8-6-16)23(25)26;;;/h4-9,14,21H,3,10-13H2,1-2H3,(H,22,24);1H;2*1H2
| Molecular Formula | C20H25N3O5 |
| Molecular Weight | 387.4296 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 | H2O |
| Molecular Weight | 18.0153 |
| 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 15:31:30 GMT 2023
by
admin
on
Fri Dec 15 15:31:30 GMT 2023
|
| Record UNII |
5N1574NNCV
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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5N1574NNCV
Created by
admin on Fri Dec 15 15:31:30 GMT 2023 , Edited by admin on Fri Dec 15 15:31:30 GMT 2023
|
PRIMARY | |||
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214493-60-4
Created by
admin on Fri Dec 15 15:31:30 GMT 2023 , Edited by admin on Fri Dec 15 15:31:30 GMT 2023
|
NON-SPECIFIC STOICHIOMETRY | |||
|
9847051
Created by
admin on Fri Dec 15 15:31:30 GMT 2023 , Edited by admin on Fri Dec 15 15:31:30 GMT 2023
|
PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
|
ANHYDROUS->SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |