5-[1,2-bis(bromanyl)-2-(3-methylphenyl)ethyl]-3-methyl-4-nitro-1,2-oxazole

Systemtic Name: 5-[1,2-bis(bromanyl)-2-(3-methylphenyl)ethyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[1,2-dibromo-2-(m-tolyl)ethyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[1,2-dibromo-2-(3-methylphenyl)ethyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[1,2-dibromo-2-(3-methylphenyl)ethyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[1,2-dibromo-2-(m-tolyl)ethyl]-3-methyl-4-nitro-isoxazole Formula: C13H12Br2N2O3 MolecularWeight: 404.05398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(C2=C(C(=NO2)C)[N+](=O)[O-])Br)Br

Isomeric SMILES

CC1=CC(=CC=C1)C(C(C2=C(C(=NO2)C)[N+](=O)[O-])Br)Br

InChI

InChI=1S/C13H12Br2N2O3/c1-7-4-3-5-9(6-7)10(14)11(15)13-12(17(18)19)8(2)16-20-13/h3-6,10-11H,1-2H3