Details
Stereochemistry | ACHIRAL |
Molecular Formula | C19H19N.C4H4O4 |
Molecular Weight | 377.433 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN1CCC2=C(C1)C3=C(CC4=C2C=CC=C4)C=CC=C3
InChI
InChIKey=AVPIBVPBCWBXIU-BTJKTKAUSA-N
InChI=1S/C19H19N.C4H4O4/c1-20-11-10-18-16-8-4-2-6-14(16)12-15-7-3-5-9-17(15)19(18)13-20;5-3(6)1-2-4(7)8/h2-9H,10-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
Molecular Formula | C19H19N |
Molecular Weight | 261.3609 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
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
Sat Dec 16 01:37:34 UTC 2023
by
admin
on
Sat Dec 16 01:37:34 UTC 2023
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Record UNII |
9VOZ30EO2Y
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Record Status |
Validated (UNII)
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Record Version |
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-
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SUB21582
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100000084886
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CHEMBL2104895
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5282470
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DBSALT001293
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176786
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m11743
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9VOZ30EO2Y
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85650-57-3
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135076
Created by
admin on Sat Dec 16 01:37:34 UTC 2023 , Edited by admin on Sat Dec 16 01:37:34 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |