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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H27NO2.ClH
Molecular Weight 313.863
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VENLAFAXINE HYDROCHLORIDE, (R)-

SMILES

Cl.COC1=CC=C(C=C1)[C@H](CN(C)C)C2(O)CCCCC2

InChI

InChIKey=QYRYFNHXARDNFZ-NTISSMGPSA-N
InChI=1S/C17H27NO2.ClH/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14;/h7-10,16,19H,4-6,11-13H2,1-3H3;1H/t16-;/m0./s1

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 C17H27NO2
Molecular Weight 277.4018
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
XS0LK87KMF
Record Status Validated (UNII)
Record Version