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ONQ

Summary
Name:~{N}-(2-azanyl-2-oxidanylidene-ethyl)-4-methoxy-benzamide
Formula:C10 H12 N2 O3
Formal charge:0
Formula weight:208.214 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-(2-azanyl-2-oxidanylidene-ethyl)-4-methoxy-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H12N2O3/c1-15-8-4-2-7(3-5-8)10(14)12-6-9(11)13/h2-5H,6H2,1H3,(H2,11,13)(H,12,14)
InChIKeyInChI1.03ZKADLOGPYJUFCB-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(cc1)C(=O)NCC(N)=O
SMILESCACTVS3.385COc1ccc(cc1)C(=O)NCC(N)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1ccc(cc1)C(=O)NCC(=O)N
SMILESOpenEye OEToolkits2.0.7COc1ccc(cc1)C(=O)NCC(=O)N

218853

PDB entries from 2024-04-24

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