Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C17H12ClN2O2.Ca |
Molecular Weight | 663.563 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].[O-]C(=O)CC1=CN(N=C1C2=CC=C(Cl)C=C2)C3=CC=CC=C3.[O-]C(=O)CC4=CN(N=C4C5=CC=C(Cl)C=C5)C6=CC=CC=C6
InChI
InChIKey=CAQGVXNKMLYRMF-UHFFFAOYSA-L
InChI=1S/2C17H13ClN2O2.Ca/c2*18-14-8-6-12(7-9-14)17-13(10-16(21)22)11-20(19-17)15-4-2-1-3-5-15;/h2*1-9,11H,10H2,(H,21,22);/q;;+2/p-2
Molecular Formula | C17H12ClN2O2 |
Molecular Weight | 311.742 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | Ca |
Molecular Weight | 40.078 |
Charge | 2 |
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 05:03:01 GMT 2023
by
admin
on
Sat Dec 16 05:03:01 GMT 2023
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Record UNII |
0H73O2AC36
|
Record Status |
Validated (UNII)
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Record Version |
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-
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278-322-8
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75821-71-5
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0H73O2AC36
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m6893
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admin on Sat Dec 16 05:03:01 GMT 2023 , Edited by admin on Sat Dec 16 05:03:01 GMT 2023
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100000092559
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SUB02968MIG
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6917852
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |