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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H25NO4S2
Molecular Weight 395.536
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROTIGOTINE SULFATE

SMILES

CCCN(CCC1=CC=CS1)[C@H]2CCC3=C(C2)C=CC=C3OS(O)(=O)=O

InChI

InChIKey=VWKVWIAVWPRBTQ-INIZCTEOSA-N
InChI=1S/C19H25NO4S2/c1-2-11-20(12-10-17-6-4-13-25-17)16-8-9-18-15(14-16)5-3-7-19(18)24-26(21,22)23/h3-7,13,16H,2,8-12,14H2,1H3,(H,21,22,23)/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H25NO4S2
Molecular Weight 395.536
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
K4K6D2GA9S
Record Status Validated (UNII)
Record Version