(4-imidazol-1-ylphenyl) 4-bromanylbenzoate

Systemtic Name: (4-imidazol-1-ylphenyl) 4-bromanylbenzoate Openeye Name: (4-imidazol-1-ylphenyl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-(1-imidazolyl)phenyl] ester IUPAC Name: (4-imidazol-1-ylphenyl) 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (4-imidazol-1-ylphenyl) ester Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)N3C=CN=C3)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)N3C=CN=C3)Br

InChI

InChI=1S/C16H11BrN2O2/c17-13-3-1-12(2-4-13)16(20)21-15-7-5-14(6-8-15)19-10-9-18-11-19/h1-11H