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O7R

Summary
Name:1-(2,3-dihydro-1-benzofuran-5-yl)ethanone
Formula:C10 H10 O2
Formal charge:0
Formula weight:162.185 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71-(2,3-dihydro-1-benzofuran-5-yl)ethanone

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C10H10O2/c1-7(11)8-2-3-10-9(6-8)4-5-12-10/h2-3,6H,4-5H2,1H3
InChIKeyInChI1.06MMVUJVASBDVNGJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)c1ccc2OCCc2c1
SMILESCACTVS3.385CC(=O)c1ccc2OCCc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7CC(=O)c1ccc2c(c1)CCO2
SMILESOpenEye OEToolkits2.0.7CC(=O)c1ccc2c(c1)CCO2

222926

PDB entries from 2024-07-24

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