[3-(4-methylphenyl)carbonyl-1,2,4-oxadiazol-5-yl] 3-methylbutanoate

Systemtic Name: [3-(4-methylphenyl)carbonyl-1,2,4-oxadiazol-5-yl] 3-methylbutanoate Openeye Name: [3-(4-methylbenzoyl)-1,2,4-oxadiazol-5-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [3-[(4-methylphenyl)-oxomethyl]-1,2,4-oxadiazol-5-yl] ester IUPAC Name: [3-(4-methylbenzoyl)-1,2,4-oxadiazol-5-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid (3-p-toluoyl-1,2,4-oxadiazol-5-yl) ester Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=NOC(=N2)OC(=O)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=NOC(=N2)OC(=O)CC(C)C

InChI

InChI=1S/C15H16N2O4/c1-9(2)8-12(18)20-15-16-14(17-21-15)13(19)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3