[3,4-bis(bromanyl)-2-methyl-butan-2-yl] 4-nitrobenzoate

Systemtic Name: [3,4-bis(bromanyl)-2-methyl-butan-2-yl] 4-nitrobenzoate Openeye Name: (2,3-dibromo-1,1-dimethyl-propyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (3,4-dibromo-2-methylbutan-2-yl) ester IUPAC Name: (3,4-dibromo-2-methylbutan-2-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2,3-dibromo-1,1-dimethyl-propyl) ester Formula: C12H13Br2NO4 MolecularWeight: 395.04392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13Br2NO4/c1-12(2,10(14)7-13)19-11(16)8-3-5-9(6-4-8)15(17)18/h3-6,10H,7H2,1-2H3