(2-bromanyl-4-methyl-phenyl) 4-methoxy-3-nitro-benzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 4-methoxy-3-nitro-benzoate Openeye Name: (2-bromo-4-methyl-phenyl) 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C15H12BrNO5 MolecularWeight: 366.16348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrNO5/c1-9-3-5-13(11(16)7-9)22-15(18)10-4-6-14(21-2)12(8-10)17(19)20/h3-8H,1-2H3