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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30N2O2
Molecular Weight 378.5072
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DOXAPRAM, (S)-

SMILES

CCN1C[C@@H](CCN2CCOCC2)C(C1=O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=XFDJYSQDBULQSI-JOCHJYFZSA-N
InChI=1S/C24H30N2O2/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,22H,2,13-19H2,1H3/t22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H30N2O2
Molecular Weight 378.5072
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:26:38 UTC 2023
Edited
by admin
on Sat Dec 16 11:26:38 UTC 2023
Record UNII
8J865SG1AT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DOXAPRAM, (S)-
Common Name English
2-PYRROLIDINONE, 1-ETHYL-4-(2-(4-MORPHOLINYL)ETHYL)-3,3-DIPHENYL-, (S)-
Systematic Name English
2-PYRROLIDINONE, 1-ETHYL-4-(2-(4-MORPHOLINYL)ETHYL)-3,3-DIPHENYL-, (4S)-
Systematic Name English
Code System Code Type Description
CAS
179915-80-1
Created by admin on Sat Dec 16 11:26:38 UTC 2023 , Edited by admin on Sat Dec 16 11:26:38 UTC 2023
PRIMARY
FDA UNII
8J865SG1AT
Created by admin on Sat Dec 16 11:26:38 UTC 2023 , Edited by admin on Sat Dec 16 11:26:38 UTC 2023
PRIMARY
PUBCHEM
28248394
Created by admin on Sat Dec 16 11:26:38 UTC 2023 , Edited by admin on Sat Dec 16 11:26:38 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER