methyl 2-[2-ethoxy-6-iodanyl-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[2-ethoxy-6-iodanyl-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy]ethanoate Openeye Name: methyl 2-[2-ethoxy-6-iodo-4-[2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenoxy]acetate CAS Name: 2-[2-ethoxy-6-iodo-4-[2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-ethoxy-6-iodo-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy]acetate Traditional Name: 2-[2-ethoxy-6-iodo-4-[2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenoxy]acetic acid methyl ester Formula: C17H17IN2O7 MolecularWeight: 488.23055

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC2=C(C(=NO2)C)[N+](=O)[O-])I)OCC(=O)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=CC2=C(C(=NO2)C)[N+](=O)[O-])I)OCC(=O)OC

InChI

InChI=1S/C17H17IN2O7/c1-4-25-14-8-11(7-12(18)17(14)26-9-15(21)24-3)5-6-13-16(20(22)23)10(2)19-27-13/h5-8H,4,9H2,1-3H3