Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

LOK

Summary
Name:methyl ~{N}-[3-(methoxycarbonylamino)phenyl]carbamate
Formula:C10 H12 N2 O4
Formal charge:0
Formula weight:224.213 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7methyl ~{N}-[3-(methoxycarbonylamino)phenyl]carbamate

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H12N2O4/c1-15-9(13)11-7-4-3-5-8(6-7)12-10(14)16-2/h3-6H,1-2H3,(H,11,13)(H,12,14)
InChIKeyInChI1.03BQFREXSKWBUSAP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COC(=O)Nc1cccc(NC(=O)OC)c1
SMILESCACTVS3.385COC(=O)Nc1cccc(NC(=O)OC)c1
SMILES_CANONICALOpenEye OEToolkits2.0.7COC(=O)Nc1cccc(c1)NC(=O)OC
SMILESOpenEye OEToolkits2.0.7COC(=O)Nc1cccc(c1)NC(=O)OC

248636

PDB entries from 2026-02-04

PDB statisticsPDBj update infoContact PDBjnumon