1ZC

(4-azanyl-1,2,5-oxadiazol-3-yl)-(3-methoxyphenyl)methanone

Created:2014-02-27
Last modified:  2014-09-05

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Chemical Details

Formal Charge0
Atom Count25
Chiral Atom Count0
Bond Count26
Aromatic Bond Count11
2D diagram of 1ZC

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Chemical Component Summary

Name(4-azanyl-1,2,5-oxadiazol-3-yl)-(3-methoxyphenyl)methanone
Systematic Name (OpenEye OEToolkits)(4-azanyl-1,2,5-oxadiazol-3-yl)-(3-methoxyphenyl)methanone
FormulaC10 H9 N3 O3
Molecular Weight219.197
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(c1cccc(OC)c1)c2nonc2N
SMILESCACTVS3.385COc1cccc(c1)C(=O)c2nonc2N
SMILESOpenEye OEToolkits1.9.2COc1cccc(c1)C(=O)c2c(non2)N
Canonical SMILESCACTVS3.385 COc1cccc(c1)C(=O)c2nonc2N
Canonical SMILESOpenEye OEToolkits1.9.2 COc1cccc(c1)C(=O)c2c(non2)N
InChIInChI1.03 InChI=1S/C10H9N3O3/c1-15-7-4-2-3-6(5-7)9(14)8-10(11)13-16-12-8/h2-5H,1H3,(H2,11,13)
InChIKeyInChI1.03 SIOKNPJSYPBGMD-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 73386682