(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-cyanobenzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-cyanobenzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H11N3O3 MolecularWeight: 305.28754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H11N3O3/c18-10-12-6-8-14(9-7-12)17(21)22-11-15-19-16(20-23-15)13-4-2-1-3-5-13/h1-9H,11H2