ONQ

~{N}-(2-azanyl-2-oxidanylidene-ethyl)-4-methoxy-benzamide

Created: 2020-03-23
Last modified:  2020-05-06

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count0
Bond Count27
Aromatic Bond Count6
2D diagram of ONQ

Chemical Component Summary

Name~{N}-(2-azanyl-2-oxidanylidene-ethyl)-4-methoxy-benzamide
Systematic Name (OpenEye OEToolkits)~{N}-(2-azanyl-2-oxidanylidene-ethyl)-4-methoxy-benzamide
FormulaC10 H12 N2 O3
Molecular Weight208.214
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385COc1ccc(cc1)C(=O)NCC(N)=O
SMILESOpenEye OEToolkits2.0.7COc1ccc(cc1)C(=O)NCC(=O)N
Canonical SMILESCACTVS3.385 COc1ccc(cc1)C(=O)NCC(N)=O
Canonical SMILESOpenEye OEToolkits2.0.7 COc1ccc(cc1)C(=O)NCC(=O)N
InChIInChI1.03 InChI=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)
InChIKeyInChI1.03 ZKADLOGPYJUFCB-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 676771