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VZC

Summary
Name:2-cyano-N-methyl-N-phenylacetamide
Formula:C10 H10 N2 O
Formal charge:0
Formula weight:174.199 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-cyano-N-methyl-N-phenylacetamide
OpenEye OEToolkits2.0.72-cyano-~{N}-methyl-~{N}-phenyl-ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CN(C(=O)CC#N)c1ccccc1
InChIInChI1.06InChI=1S/C10H10N2O/c1-12(10(13)7-8-11)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKeyInChI1.06TYNMTKVSZGKSFB-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CN(C(=O)CC#N)c1ccccc1
SMILESCACTVS3.385CN(C(=O)CC#N)c1ccccc1
SMILES_CANONICALOpenEye OEToolkits2.0.7CN(c1ccccc1)C(=O)CC#N
SMILESOpenEye OEToolkits2.0.7CN(c1ccccc1)C(=O)CC#N

222415

數據於2024-07-10公開中

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