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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H29NO2.C3H4O4
Molecular Weight 443.5326
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROPOXYPHENE MALONATE

SMILES

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

InChI

InChIKey=RHUFCQJLAFEIJR-MYXGOWFTSA-N
InChI=1S/C22H29NO2.C3H4O4/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;4-2(5)1-3(6)7/h6-15,18H,5,16-17H2,1-4H3;1H2,(H,4,5)(H,6,7)/t18-,22+;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
PROPOXYPHENE MALONATE
Common Name English
PROPANEDIOIC ACID, COMPD. WITH 3-(DIMETHYLAMINO)-1-(3-METHOXYPHENYL)-2-METHYL-1-(PHENYLMETHYL)PROPYL PROPANOATE (1:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20958953
Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023
PRIMARY
FDA UNII
W4494CHJ3W
Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023
PRIMARY
PUBCHEM
56840911
Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023
PRIMARY
CAS
37947-49-2
Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023
PRIMARY