[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 4-cyanobenzoate

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 4-cyanobenzoate Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl ester Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C20H16N2O5/c1-24-17-8-7-15(9-19(17)25-2)18-10-16(22-27-18)12-26-20(23)14-5-3-13(11-21)4-6-14/h3-10H,12H2,1-2H3