[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl 3-iodanylbenzoate

Systemtic Name: [5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl 3-iodanylbenzoate Openeye Name: [5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl 3-iodobenzoate CAS Name: 3-iodobenzoic acid [5-(5-methyl-3-phenyl-4-isoxazolyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C20H14IN3O4 MolecularWeight: 487.24733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)COC(=O)C4=CC(=CC=C4)I

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)COC(=O)C4=CC(=CC=C4)I

InChI

InChI=1S/C20H14IN3O4/c1-12-17(18(24-28-12)13-6-3-2-4-7-13)19-23-22-16(27-19)11-26-20(25)14-8-5-9-15(21)10-14/h2-10H,11H2,1H3