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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H17Cl2NO2
Molecular Weight 302.196
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DICHLOROMETHYLPHENIDATE, R,R-

SMILES

[H][C@@]1(CCCCN1)[C@H](C(=O)OC)C2=CC(Cl)=C(Cl)C=C2

InChI

InChIKey=JUKMAYKVHWKRKY-CHWSQXEVSA-N
InChI=1S/C14H17Cl2NO2/c1-19-14(18)13(12-4-2-3-7-17-12)9-5-6-10(15)11(16)8-9/h5-6,8,12-13,17H,2-4,7H2,1H3/t12-,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H17Cl2NO2
Molecular Weight 302.196
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
1MM9174NWD
Record Status Validated (UNII)
Record Version