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Details

Stereochemistry ACHIRAL
Molecular Formula C9H21NO6S2.ClH
Molecular Weight 339.857
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-METHYL-3,3'-DIMESYLOXYDIPROPYLAMINE HYDROCHLORIDE

SMILES

Cl.CN(CCCOS(C)(=O)=O)CCCOS(C)(=O)=O

InChI

InChIKey=JJGLBMVWNLDXTM-UHFFFAOYSA-N
InChI=1S/C9H21NO6S2.ClH/c1-10(6-4-8-15-17(2,11)12)7-5-9-16-18(3,13)14;/h4-9H2,1-3H3;1H

HIDE SMILES / InChI
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C9H21NO6S2
Molecular Weight 303.396
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
149,124
Substance Class Chemical
Record UNII
1A240UYN3Z
Record Status Validated (UNII)
Record Version
NIH
NCATS
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