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

Systemtic Name: 3-[5-oxidanylidene-2-(3-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile Openeye Name: 3-[2-(3-benzyloxyphenyl)-5-oxo-1,3,4-oxadiazin-4-yl]propanenitrile CAS Name: 3-[5-oxo-2-(3-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile IUPAC Name: 3-[5-oxo-2-(3-phenylmethoxyphenyl)-1,3,4-oxadiazin-4-yl]propanenitrile Traditional Name: 3-[2-(3-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(=CC=C2)OCC3=CC=CC=C3)CCC#N

Isomeric SMILES

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

InChI

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