2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3,5-bis(iodanyl)benzoate

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3,5-bis(iodanyl)benzoate Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methoxy]-3,5-diiodo-benzoate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methoxy]-3,5-diiodobenzoate IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3,5-diiodobenzoate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methoxy]-3,5-diiodo-benzoate Formula: C13H10I2NO4- MolecularWeight: 498.03174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=C(C=C(C=C2C(=O)[O-])I)I

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=C(C=C(C=C2C(=O)[O-])I)I

InChI

InChI=1S/C13H11I2NO4/c1-6-10(7(2)20-16-6)5-19-12-9(13(17)18)3-8(14)4-11(12)15/h3-4H,5H2,1-2H3,(H,17,18)/p-1