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

Systemtic Name: 5-[(E)-2-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[(E)-2-(3-bromo-5-ethoxy-4-propoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[(E)-2-(3-bromo-5-ethoxy-4-propoxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[(E)-2-(3-bromo-5-ethoxy-4-propoxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[(E)-2-(3-bromo-5-ethoxy-4-propoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C17H19BrN2O5 MolecularWeight: 411.24716

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=CC2=C(C(=NO2)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C/C2=C(C(=NO2)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C17H19BrN2O5/c1-4-8-24-17-13(18)9-12(10-15(17)23-5-2)6-7-14-16(20(21)22)11(3)19-25-14/h6-7,9-10H,4-5,8H2,1-3H3/b7-6+