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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H20N2O2
Molecular Weight 236.3101
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 4-((DIMETHYLAMINO)METHYL)-3,5-DIMETHYLPHENYLCARBAMATE

SMILES

CNC(=O)OC1=CC(C)=C(CN(C)C)C(C)=C1

InChI

InChIKey=PBJQYLSKNASHPU-UHFFFAOYSA-N
InChI=1S/C13H20N2O2/c1-9-6-11(17-13(16)14-3)7-10(2)12(9)8-15(4)5/h6-7H,8H2,1-5H3,(H,14,16)

HIDE SMILES / InChI

Molecular Formula C13H20N2O2
Molecular Weight 236.3101
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:00:06 GMT 2025
Edited
by admin
on Tue Apr 01 20:00:06 GMT 2025
Record UNII
C2OUP9DPC8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 4-((DIMETHYLAMINO)METHYL)-3,5-DIMETHYLPHENYLCARBAMATE
Systematic Name English
NSC-190928
Preferred Name English
PHENOL, 4-((DIMETHYLAMINO)METHYL)-3,5-DIMETHYL-, 1-(N-METHYLCARBAMATE)
Systematic Name English
WE 417
Common Name English
CARBAMIC ACID, METHYL-, 4-((DIMETHYLAMINO)METHYL)-3,5-DIMETHYLPHENYL ESTER
Common Name English
PHENOL, 4-((DIMETHYLAMINO)METHYL)-3,5-DIMETHYL-, METHYLCARBAMATE (ESTER)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80214789
Created by admin on Tue Apr 01 20:00:06 GMT 2025 , Edited by admin on Tue Apr 01 20:00:06 GMT 2025
PRIMARY
NSC
190928
Created by admin on Tue Apr 01 20:00:06 GMT 2025 , Edited by admin on Tue Apr 01 20:00:06 GMT 2025
PRIMARY
PUBCHEM
22956
Created by admin on Tue Apr 01 20:00:06 GMT 2025 , Edited by admin on Tue Apr 01 20:00:06 GMT 2025
PRIMARY
FDA UNII
C2OUP9DPC8
Created by admin on Tue Apr 01 20:00:06 GMT 2025 , Edited by admin on Tue Apr 01 20:00:06 GMT 2025
PRIMARY
CAS
6452-64-8
Created by admin on Tue Apr 01 20:00:06 GMT 2025 , Edited by admin on Tue Apr 01 20:00:06 GMT 2025
PRIMARY