[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(3-bromanylphenoxy)ethanoate Openeye Name: [3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H15BrN2O4/c1-12-5-7-13(8-6-12)18-20-16(25-21-18)10-24-17(22)11-23-15-4-2-3-14(19)9-15/h2-9H,10-11H2,1H3