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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H29NO2
Molecular Weight 339.4712
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPROPOXYPHENE

SMILES

CCC(=O)O[C@@](CC1=CC=CC=C1)([C@@H](C)CN(C)C)C2=CC=CC=C2

InChI

InChIKey=XLMALTXPSGQGBX-AVRDEDQJSA-N
InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19/h6-15,18H,5,16-17H2,1-4H3/t18-,22-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ISOPROPOXYPHENE
Common Name English
BENZENEETHANOL, .ALPHA.-((1S)-2-(DIMETHYLAMINO)-1-METHYLETHYL)-.ALPHA.-PHENYL-, 1-PROPANOATE, (.ALPHA.S)-
Systematic Name English
DEXTROPROPOXYPHENE HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Common Name English
(1S,2S)-1-BENZYL-3-(DIMETHYLAMINO)-2-METHYL-1-PHENYLPROPYL PROPANOATE
Systematic Name English
Code System Code Type Description
CAS
701900-96-1
Created by admin on Sat Dec 16 09:43:18 GMT 2023 , Edited by admin on Sat Dec 16 09:43:18 GMT 2023
PRIMARY
FDA UNII
U7W6THX4M0
Created by admin on Sat Dec 16 09:43:18 GMT 2023 , Edited by admin on Sat Dec 16 09:43:18 GMT 2023
PRIMARY
PUBCHEM
441275
Created by admin on Sat Dec 16 09:43:18 GMT 2023 , Edited by admin on Sat Dec 16 09:43:18 GMT 2023
PRIMARY