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Details

Stereochemistry RACEMIC
Molecular Formula C21H23NO2
Molecular Weight 321.4128
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DIHYDRODIOLNAFTIFINE

SMILES

CN(C\C=C\C1=CC=CC=C1)CC2=C[C@H](O)[C@@H](O)C3=CC=CC=C23

InChI

InChIKey=TZQLHUPOSGNJNN-OYIMBBQMSA-N
InChI=1S/C21H23NO2/c1-22(13-7-10-16-8-3-2-4-9-16)15-17-14-20(23)21(24)19-12-6-5-11-18(17)19/h2-12,14,20-21,23-24H,13,15H2,1H3/b10-7+/t20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H23NO2
Molecular Weight 321.4128
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
73Q5LS85OJ
Record Status Validated (UNII)
Record Version