(4-bromanyl-2-fluoranyl-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H11BrFN3O2 MolecularWeight: 376.179843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=C(C=C(C=C2)Br)F)N3C=NC=N3

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=C(C=C(C=C2)Br)F)N3C=NC=N3

InChI

InChI=1S/C16H11BrFN3O2/c17-13-4-1-12(15(18)7-13)8-23-16(22)11-2-5-14(6-3-11)21-10-19-9-20-21/h1-7,9-10H,8H2