3-[5-oxidanylidene-2-(4-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile

Systemtic Name: 3-[5-oxidanylidene-2-(4-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile Openeye Name: 3-[2-(4-benzyloxyphenyl)-5-oxo-1,3,4-oxadiazin-4-yl]propanenitrile CAS Name: 3-[5-oxo-2-(4-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile IUPAC Name: 3-[5-oxo-2-(4-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile Traditional Name: 3-[2-(4-benzoxyphenyl)-5-keto-1,3,4-oxadiazin-4-yl]propionitrile Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(N=C(O1)C2=CC=C(C=C2)OCC3=CC=CC=C3)CCC#N

Isomeric SMILES

C1C(=O)N(N=C(O1)C2=CC=C(C=C2)OCC3=CC=CC=C3)CCC#N

InChI

InChI=1S/C19H17N3O3/c20-11-4-12-22-18(23)14-25-19(21-22)16-7-9-17(10-8-16)24-13-15-5-2-1-3-6-15/h1-3,5-10H,4,12-14H2