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

Systemtic Name: 5-[(E)-2-(5-bromanyl-2-methoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[(E)-2-(5-bromo-2-methoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[(E)-2-(5-bromo-2-methoxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[(E)-2-(5-bromo-2-methoxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[(E)-2-(5-bromo-2-methoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C13H11BrN2O4 MolecularWeight: 339.14144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrN2O4/c1-8-13(16(17)18)12(20-15-8)5-3-9-7-10(14)4-6-11(9)19-2/h3-7H,1-2H3/b5-3+