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Details

Stereochemistry RACEMIC
Molecular Formula C19H23NO3.ClH
Molecular Weight 349.852
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ARMEPAVINE HYDROCHLORIDE, (±)-

SMILES

Cl.COC1=CC2=C(C=C1OC)C(CC3=CC=C(O)C=C3)N(C)CC2

InChI

InChIKey=KKGCFFPGUNXVTJ-UHFFFAOYSA-N
InChI=1S/C19H23NO3.ClH/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13;/h4-7,11-12,17,21H,8-10H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C19H23NO3
Molecular Weight 313.3908
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

Approval Year

Substance Class Chemical
Record UNII
A9XDQ29903
Record Status Validated (UNII)
Record Version