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

Systemtic Name: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate Openeye Name: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H18N2O6S/c1-3-28(23,24)16-7-5-4-6-15(16)19(22)26-12-17-20-18(21-27-17)13-8-10-14(25-2)11-9-13/h4-11H,3,12H2,1-2H3