2-[3-(3-methoxy-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-5-yl]ethanenitrile

Systemtic Name: 2-[3-(3-methoxy-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-5-yl]ethanenitrile Openeye Name: 2-[3-(4-isopropoxy-3-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]acetonitrile CAS Name: 2-[3-(3-methoxy-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile IUPAC Name: 2-[3-(3-methoxy-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-5-yl]acetonitrile Traditional Name: 2-[3-(4-isopropoxy-3-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]acetonitrile Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=NOC(=N2)CC#N)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=NOC(=N2)CC#N)OC

InChI

InChI=1S/C14H15N3O3/c1-9(2)19-11-5-4-10(8-12(11)18-3)14-16-13(6-7-15)20-17-14/h4-5,8-9H,6H2,1-3H3