Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H16O6.C18H21ClN2 |
| Molecular Weight | 689.195 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1CCN(CC1)[C@@H](C2=CC=CC=C2)C3=CC=C(Cl)C=C3.OC(=O)C4=C(O)C(CC5=C6C=CC=CC6=CC(C(O)=O)=C5O)=C7C=CC=CC7=C4
InChI
InChIKey=WUJMCJWDNKVBOU-MXHDAQFASA-N
InChI=1S/C23H16O6.C18H21ClN2/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16/h1-10,24-25H,11H2,(H,26,27)(H,28,29);2-10,18H,11-14H2,1H3/t;18-/m.0/s1
| Molecular Formula | C23H16O6 |
| Molecular Weight | 388.3695 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C18H21ClN2 |
| Molecular Weight | 300.826 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:12:38 GMT 2025
by
admin
on
Mon Mar 31 23:12:38 GMT 2025
|
| Record UNII |
93ZJZ83004
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Preferred Name | English | ||
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Common Name | English |
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93ZJZ83004
Created by
admin on Mon Mar 31 23:12:38 GMT 2025 , Edited by admin on Mon Mar 31 23:12:38 GMT 2025
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PRIMARY | |||
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76967293
Created by
admin on Mon Mar 31 23:12:38 GMT 2025 , Edited by admin on Mon Mar 31 23:12:38 GMT 2025
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PRIMARY |
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RACEMATE -> ENANTIOMER |
