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

Details

Stereochemistry UNKNOWN
Molecular Formula C9H19ClN3O5P
Molecular Weight 315.691
Optical Activity ( - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOTEMUSTINE, (-)-

SMILES

CCOP(=O)(OCC)C(C)NC(=O)N(CCCl)N=O

InChI

InChIKey=YAKWPXVTIGTRJH-UHFFFAOYSA-N
InChI=1S/C9H19ClN3O5P/c1-4-17-19(16,18-5-2)8(3)11-9(14)13(12-15)7-6-10/h8H,4-7H2,1-3H3,(H,11,14)

HIDE SMILES / InChI

Molecular Formula C9H19ClN3O5P
Molecular Weight 315.691
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:06:50 UTC 2023
Edited
by admin
on Sat Dec 16 11:06:50 UTC 2023
Record UNII
QY93P3GN94
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FOTEMUSTINE, (-)-
Common Name English
PHOSPHONIC ACID, (1-((((2-CHLOROETHYL)NITROSOAMINO)CARBONYL)AMINO)ETHYL)-, DIETHYL ESTER, (-)-
Systematic Name English
Code System Code Type Description
CAS
191219-77-9
Created by admin on Sat Dec 16 11:06:50 UTC 2023 , Edited by admin on Sat Dec 16 11:06:50 UTC 2023
PRIMARY
FDA UNII
QY93P3GN94
Created by admin on Sat Dec 16 11:06:50 UTC 2023 , Edited by admin on Sat Dec 16 11:06:50 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER