[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=CC=C3S(=O)(=O)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=CC=C3S(=O)(=O)CC

InChI

InChI=1S/C20H20N2O5S/c1-3-14-9-11-15(12-10-14)19-21-18(27-22-19)13-26-20(23)16-7-5-6-8-17(16)28(24,25)4-2/h5-12H,3-4,13H2,1-2H3