Details
Stereochemistry | ACHIRAL |
Molecular Formula | C10H16N2.C7H8O3S |
Molecular Weight | 336.449 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.CCN(CC)C2=CC=C(N)C=C2
InChI
InChIKey=LSNIJCHJIXRASO-UHFFFAOYSA-N
InChI=1S/C10H16N2.C7H8O3S/c1-3-12(4-2)10-7-5-9(11)6-8-10;1-6-2-4-7(5-3-6)11(8,9)10/h5-8H,3-4,11H2,1-2H3;2-5H,1H3,(H,8,9,10)
Molecular Formula | C10H16N2 |
Molecular Weight | 164.2474 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C7H8O3S |
Molecular Weight | 172.202 |
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 12:11:43 GMT 2023
by
admin
on
Sat Dec 16 12:11:43 GMT 2023
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Record UNII |
WKN992Y7A2
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Record Status |
Validated (UNII)
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Record Version |
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172735
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275-211-6
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71130-49-9
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WKN992Y7A2
Created by
admin on Sat Dec 16 12:11:44 GMT 2023 , Edited by admin on Sat Dec 16 12:11:44 GMT 2023
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PARENT -> SALT/SOLVATE |
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