U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H21NO.ClH
Molecular Weight 291.816
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-BENZYLPSEUDOEPHEDRINE HYDROCHLORIDE

SMILES

Cl.C[C@@H]([C@@H](O)C1=CC=CC=C1)N(C)CC2=CC=CC=C2

InChI

InChIKey=GSPYITMLMNEMDS-SQQLFYIASA-N
InChI=1S/C17H21NO.ClH/c1-14(17(19)16-11-7-4-8-12-16)18(2)13-15-9-5-3-6-10-15;/h3-12,14,17,19H,13H2,1-2H3;1H/t14-,17+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C17H21NO
Molecular Weight 255.3547
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 11:21:49 UTC 2023
Edited
by admin
on Sat Dec 16 11:21:49 UTC 2023
Record UNII
Z9XGT2N2RW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-BENZYLPSEUDOEPHEDRINE HYDROCHLORIDE
Common Name English
Benzenemethanol, α-[(1S)-1-[methyl(phenylmethyl)amino]ethyl]-, hydrochloride (1:1), (αS)-
Systematic Name English
Benzphetamine Related Compound E [USP-RS]
Common Name English
(1S,2S)-2-[Benzyl(methyl)amino]-1-phenylpropan-1-ol hydrochloride
Systematic Name English
Code System Code Type Description
PUBCHEM
166177181
Created by admin on Sat Dec 16 11:21:49 UTC 2023 , Edited by admin on Sat Dec 16 11:21:49 UTC 2023
PRIMARY
CAS
1591807-86-1
Created by admin on Sat Dec 16 11:21:49 UTC 2023 , Edited by admin on Sat Dec 16 11:21:49 UTC 2023
PRIMARY
FDA UNII
Z9XGT2N2RW
Created by admin on Sat Dec 16 11:21:49 UTC 2023 , Edited by admin on Sat Dec 16 11:21:49 UTC 2023
PRIMARY
RS_ITEM_NUM
1059058
Created by admin on Sat Dec 16 11:21:49 UTC 2023 , Edited by admin on Sat Dec 16 11:21:49 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE