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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H30N2O3S
Molecular Weight 402.55
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRANS-4-(METHOXYMETHYL)-4-(PHENYLPROPANOYLAMINO)-1-(2-(THIOPHEN-2-YL)ETHYL)PIPERIDINE 1-OXIDE

SMILES

CCC(=O)N(C1=CC=CC=C1)[C@]2(COC)CC[N@@+]([O-])(CCC3=CC=CS3)CC2

InChI

InChIKey=NRPKXYWXMSLIIC-QUPDYRNUSA-N
InChI=1S/C22H30N2O3S/c1-3-21(25)23(19-8-5-4-6-9-19)22(18-27-2)12-15-24(26,16-13-22)14-11-20-10-7-17-28-20/h4-10,17H,3,11-16,18H2,1-2H3/t22-,24+

HIDE SMILES / InChI

Molecular Formula C22H30N2O3S
Molecular Weight 402.55
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 20:30:41 UTC 2023
Edited
by admin
on Thu Jul 06 20:30:41 UTC 2023
Record UNII
AJ6F5L7LC8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRANS-4-(METHOXYMETHYL)-4-(PHENYLPROPANOYLAMINO)-1-(2-(THIOPHEN-2-YL)ETHYL)PIPERIDINE 1-OXIDE
Systematic Name English
SUFENTANIL IMPURITY I [EP IMPURITY]
Common Name English
SUFENTANIL CITRATE IMPURITY I [EP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
AJ6F5L7LC8
Created by admin on Thu Jul 06 20:30:41 UTC 2023 , Edited by admin on Thu Jul 06 20:30:41 UTC 2023
PRIMARY
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