1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl 4-iodanylbenzoate

Systemtic Name: 1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl 4-iodanylbenzoate Openeye Name: 1-[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]ethyl 4-iodobenzoate CAS Name: 4-iodobenzoic acid 1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl ester IUPAC Name: 1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl 4-iodobenzoate Traditional Name: 4-iodobenzoic acid 1-[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]ethyl ester Formula: C18H15IN2O3 MolecularWeight: 434.22777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)C(C)OC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)C(C)OC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C18H15IN2O3/c1-11-3-5-13(6-4-11)17-21-20-16(24-17)12(2)23-18(22)14-7-9-15(19)10-8-14/h3-10,12H,1-2H3