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

A4Z

Summary
Name:2-(4-butoxyphenyl)-N-hydroxyacetamide
Formula:C12 H17 N O3
Formal charge:0
Formula weight:223.268 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-(4-butoxyphenyl)-N-hydroxyacetamide
OpenEye OEToolkits1.9.22-(4-butoxyphenyl)-N-oxidanyl-ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(C(=O)NO)c1ccc(cc1)OCCCC
InChIInChI1.03InChI=1S/C12H17NO3/c1-2-3-8-16-11-6-4-10(5-7-11)9-12(14)13-15/h4-7,15H,2-3,8-9H2,1H3,(H,13,14)
InChIKeyInChI1.03MXJWRABVEGLYDG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCOc1ccc(CC(=O)NO)cc1
SMILESCACTVS3.385CCCCOc1ccc(CC(=O)NO)cc1
SMILES_CANONICALOpenEye OEToolkits1.9.2CCCCOc1ccc(cc1)CC(=O)NO
SMILESOpenEye OEToolkits1.9.2CCCCOc1ccc(cc1)CC(=O)NO

227344

數據於2024-11-13公開中

PDB statisticsPDBj update infoContact PDBjnumon