[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-(methylsulfonylmethyl)benzoate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=CC=C(C=C2)CS(=O)(=O)C

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC=C(C=C2)CS(=O)(=O)C

InChI

InChI=1S/C16H20N2O5S/c1-11(2)8-14-17-15(23-18-14)9-22-16(19)13-6-4-12(5-7-13)10-24(3,20)21/h4-7,11H,8-10H2,1-3H3