(3-bromanyl-2-pyridin-2-yl-phenyl) benzoate

Systemtic Name: (3-bromanyl-2-pyridin-2-yl-phenyl) benzoate Openeye Name: [3-bromo-2-(2-pyridyl)phenyl] benzoate CAS Name: benzoic acid [3-bromo-2-(2-pyridinyl)phenyl] ester IUPAC Name: (3-bromo-2-pyridin-2-ylphenyl) benzoate Traditional Name: benzoic acid [3-bromo-2-(2-pyridyl)phenyl] ester Formula: C18H12BrNO2 MolecularWeight: 354.19738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(C(=CC=C2)Br)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(C(=CC=C2)Br)C3=CC=CC=N3

InChI

InChI=1S/C18H12BrNO2/c19-14-9-6-11-16(17(14)15-10-4-5-12-20-15)22-18(21)13-7-2-1-3-8-13/h1-12H