[1-bromanyl-2-methyl-3-(2-nitro-5-oxidanyl-phenoxy)propan-2-yl] ethanoate

Systemtic Name: [1-bromanyl-2-methyl-3-(2-nitro-5-oxidanyl-phenoxy)propan-2-yl] ethanoate Openeye Name: [1-(bromomethyl)-2-(5-hydroxy-2-nitro-phenoxy)-1-methyl-ethyl] acetate CAS Name: acetic acid [1-bromo-3-(5-hydroxy-2-nitrophenoxy)-2-methylpropan-2-yl] ester IUPAC Name: [1-bromo-3-(5-hydroxy-2-nitrophenoxy)-2-methylpropan-2-yl] acetate Traditional Name: acetic acid [1-(bromomethyl)-2-(5-hydroxy-2-nitro-phenoxy)-1-methyl-ethyl] ester Formula: C12H14BrNO6 MolecularWeight: 348.14666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(COC1=C(C=CC(=C1)O)[N+](=O)[O-])CBr

Isomeric SMILES

CC(=O)OC(C)(COC1=C(C=CC(=C1)O)[N+](=O)[O-])CBr

InChI

InChI=1S/C12H14BrNO6/c1-8(15)20-12(2,6-13)7-19-11-5-9(16)3-4-10(11)14(17)18/h3-5,16H,6-7H2,1-2H3