(4-methoxyphenyl) 4-bromanyl-3-nitro-benzoate

Systemtic Name: (4-methoxyphenyl) 4-bromanyl-3-nitro-benzoate Openeye Name: (4-methoxyphenyl) 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid (4-methoxyphenyl) ester Formula: C14H10BrNO5 MolecularWeight: 352.1369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H10BrNO5/c1-20-10-3-5-11(6-4-10)21-14(17)9-2-7-12(15)13(8-9)16(18)19/h2-8H,1H3