(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-oxidanylidene-4-(4-phenylphenyl)butanoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-oxidanylidene-4-(4-phenylphenyl)butanoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-oxo-4-(4-phenylphenyl)butanoate CAS Name: 4-oxo-4-(4-phenylphenyl)butanoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-oxo-4-(4-phenylphenyl)butanoate Traditional Name: 4-keto-4-(4-phenylphenyl)butyric acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCC(=O)OCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCC(=O)OCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C25H20N2O4/c28-22(20-13-11-19(12-14-20)18-7-3-1-4-8-18)15-16-24(29)30-17-23-26-25(27-31-23)21-9-5-2-6-10-21/h1-14H,15-17H2