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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H19N3O3
Molecular Weight 265.3083
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONOMETHYL KARBUTILATE

SMILES

CNC(=O)NC1=CC(OC(=O)NC(C)(C)C)=CC=C1

InChI

InChIKey=SSFHUMHURJORHS-UHFFFAOYSA-N
InChI=1S/C13H19N3O3/c1-13(2,3)16-12(18)19-10-7-5-6-9(8-10)15-11(17)14-4/h5-8H,1-4H3,(H,16,18)(H2,14,15,17)

HIDE SMILES / InChI

Approval Year

Name Type Language
MONOMETHYL KARBUTILATE
Common Name English
NSC-222496
Code English
NIA-7452
Code English
CARBAMIC ACID, (1,1-DIMETHYLETHYL)-, 3-(((METHYLAMINO)CARBONYL)AMINO)PHENYL ESTER
Systematic Name English
CARBAMIC ACID, TERT-BUTYL-, ESTER WITH 1-(M-HYDROXYPHENYL)-3-METHYLUREA
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID90197539
Created by admin on Sat Dec 16 12:56:45 GMT 2023 , Edited by admin on Sat Dec 16 12:56:45 GMT 2023
PRIMARY
CAS
4849-42-7
Created by admin on Sat Dec 16 12:56:45 GMT 2023 , Edited by admin on Sat Dec 16 12:56:45 GMT 2023
PRIMARY
PUBCHEM
99414
Created by admin on Sat Dec 16 12:56:45 GMT 2023 , Edited by admin on Sat Dec 16 12:56:45 GMT 2023
PRIMARY
NSC
222496
Created by admin on Sat Dec 16 12:56:45 GMT 2023 , Edited by admin on Sat Dec 16 12:56:45 GMT 2023
PRIMARY
FDA UNII
P6EP33CYP3
Created by admin on Sat Dec 16 12:56:45 GMT 2023 , Edited by admin on Sat Dec 16 12:56:45 GMT 2023
PRIMARY