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Details

Stereochemistry RACEMIC
Molecular Formula C13H18N2O
Molecular Weight 218.2948
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RO-3-1914

SMILES

CNC(C)CC1=CNC2=CC=C(OC)C=C12

InChI

InChIKey=IYEMYZOLBLHKFE-UHFFFAOYSA-N
InChI=1S/C13H18N2O/c1-9(14-2)6-10-8-15-13-5-4-11(16-3)7-12(10)13/h4-5,7-9,14-15H,6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H18N2O
Molecular Weight 218.2948
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
PJ8WT93MNQ
Record Status Validated (UNII)
Record Version