2-[3-(2,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethanenitrile

Systemtic Name: 2-[3-(2,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethanenitrile Openeye Name: 2-[3-(2,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile CAS Name: 2-[3-(2,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile IUPAC Name: 2-[3-(2,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile Traditional Name: 2-(3-asaryl-1,2,4-oxadiazol-5-yl)acetonitrile Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NOC(=N2)CC#N)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=NOC(=N2)CC#N)OC)OC

InChI

InChI=1S/C13H13N3O4/c1-17-9-7-11(19-3)10(18-2)6-8(9)13-15-12(4-5-14)20-16-13/h6-7H,4H2,1-3H3