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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H21NO.ClH
Molecular Weight 327.848
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-hydroxy-N-methyl-2-(naphthalen-2-yl)-3-phenylpropan-1-amine hydrochloride, (2R,3R)-

SMILES

Cl.CNC[C@H]([C@@H](O)C1=CC=CC=C1)C2=CC3=C(C=CC=C3)C=C2

InChI

InChIKey=VKGOWJUMLCDORI-FKLPMGAJSA-N
InChI=1S/C20H21NO.ClH/c1-21-14-19(20(22)16-8-3-2-4-9-16)18-12-11-15-7-5-6-10-17(15)13-18;/h2-13,19-22H,14H2,1H3;1H/t19-,20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C20H21NO
Molecular Weight 291.3868
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:17:36 GMT 2023
Edited
by admin
on Sat Dec 16 19:17:36 GMT 2023
Record UNII
7REF5XGM2X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-hydroxy-N-methyl-2-(naphthalen-2-yl)-3-phenylpropan-1-amine hydrochloride, (2R,3R)-
Systematic Name English
2-Naphthaleneethanol, β-[(methylamino)methyl]-α-phenyl-, hydrochloride (1:1), (αR,βR)-
Systematic Name English
(2R,3R)-3-hydroxy-N-methyl-2-(naphthalen-2-yl)-3-phenylpropan-1-amine hydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
7REF5XGM2X
Created by admin on Sat Dec 16 19:17:36 GMT 2023 , Edited by admin on Sat Dec 16 19:17:36 GMT 2023
PRIMARY
PUBCHEM
68767180
Created by admin on Sat Dec 16 19:17:36 GMT 2023 , Edited by admin on Sat Dec 16 19:17:36 GMT 2023
PRIMARY
CAS
1172111-78-2
Created by admin on Sat Dec 16 19:17:36 GMT 2023 , Edited by admin on Sat Dec 16 19:17:36 GMT 2023
PRIMARY