5-[(E)-2-[3,5-bis(iodanyl)-2-propan-2-yloxy-phenyl]ethenyl]-3-methyl-4-nitro-1,2-oxazole

Systemtic Name: 5-[(E)-2-[3,5-bis(iodanyl)-2-propan-2-yloxy-phenyl]ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[(E)-2-(3,5-diiodo-2-isopropoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[(E)-2-(3,5-diiodo-2-propan-2-yloxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[(E)-2-(3,5-diiodo-2-propan-2-yloxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[(E)-2-(3,5-diiodo-2-isopropoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C15H14I2N2O4 MolecularWeight: 540.0916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC(=CC(=C2OC(C)C)I)I

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=CC(=CC(=C2OC(C)C)I)I

InChI

InChI=1S/C15H14I2N2O4/c1-8(2)22-15-10(6-11(16)7-12(15)17)4-5-13-14(19(20)21)9(3)18-23-13/h4-8H,1-3H3/b5-4+