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

Systemtic Name: 2-[2-oxidanylidene-5-(4-phenylmethoxyphenyl)-1,3,4-oxadiazol-3-yl]ethanenitrile Openeye Name: 2-[5-(4-benzyloxyphenyl)-2-oxo-1,3,4-oxadiazol-3-yl]acetonitrile CAS Name: 2-[2-oxo-5-(4-phenylmethoxyphenyl)-1,3,4-oxadiazol-3-yl]acetonitrile IUPAC Name: 2-[2-oxo-5-(4-phenylmethoxyphenyl)-1,3,4-oxadiazol-3-yl]acetonitrile Traditional Name: 2-[5-(4-benzoxyphenyl)-2-keto-1,3,4-oxadiazol-3-yl]acetonitrile Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C(=O)O3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C(=O)O3)CC#N

InChI

InChI=1S/C17H13N3O3/c18-10-11-20-17(21)23-16(19-20)14-6-8-15(9-7-14)22-12-13-4-2-1-3-5-13/h1-9H,11-12H2