Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H12ClNO3.H3N |
Molecular Weight | 318.755 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N.C[C@H](C(O)=O)C1=CC2=C(OC(=N2)C3=CC=C(Cl)C=C3)C=C1
InChI
InChIKey=DNGLOBZMXKFACM-FVGYRXGTSA-N
InChI=1S/C16H12ClNO3.H3N/c1-9(16(19)20)11-4-7-14-13(8-11)18-15(21-14)10-2-5-12(17)6-3-10;/h2-9H,1H3,(H,19,20);1H3/t9-;/m0./s1
Molecular Formula | C16H12ClNO3 |
Molecular Weight | 301.724 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | H3N |
Molecular Weight | 17.0305 |
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 10:24:31 UTC 2023
by
admin
on
Sat Dec 16 10:24:31 UTC 2023
|
Record UNII |
H7150TB7TY
|
Record Status |
Validated (UNII)
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Record Version |
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-
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H7150TB7TY
Created by
admin on Sat Dec 16 10:24:31 UTC 2023 , Edited by admin on Sat Dec 16 10:24:31 UTC 2023
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91827211
Created by
admin on Sat Dec 16 10:24:31 UTC 2023 , Edited by admin on Sat Dec 16 10:24:31 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |