[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 1-oxidanylcyclohexane-1-carboxylate

Systemtic Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 1-oxidanylcyclohexane-1-carboxylate Openeye Name: [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl 1-hydroxycyclohexanecarboxylate CAS Name: 1-hydroxy-1-cyclohexanecarboxylic acid [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 1-hydroxycyclohexane-1-carboxylate Traditional Name: 1-hydroxycyclohexanecarboxylic acid [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)C3(CCCCC3)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)C3(CCCCC3)O

InChI

InChI=1S/C17H20N2O4/c1-12-5-7-13(8-6-12)15-18-14(19-23-15)11-22-16(20)17(21)9-3-2-4-10-17/h5-8,21H,2-4,9-11H2,1H3