5-[2-(4-butoxy-3-ethoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole

Systemtic Name: 5-[2-(4-butoxy-3-ethoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[2-(4-butoxy-3-ethoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[2-(4-butoxy-3-ethoxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[2-(4-butoxy-3-ethoxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[2-(4-butoxy-3-ethoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC2=C(C(=NO2)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C=CC2=C(C(=NO2)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C18H22N2O5/c1-4-6-11-24-15-9-7-14(12-17(15)23-5-2)8-10-16-18(20(21)22)13(3)19-25-16/h7-10,12H,4-6,11H2,1-3H3