(2-chloranyl-6-fluoranyl-phenyl)methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 4-pyrazol-1-ylbenzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C17H12ClFN2O2 MolecularWeight: 330.740783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)COC(=O)C2=CC=C(C=C2)N3C=CC=N3)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)COC(=O)C2=CC=C(C=C2)N3C=CC=N3)F

InChI

InChI=1S/C17H12ClFN2O2/c18-15-3-1-4-16(19)14(15)11-23-17(22)12-5-7-13(8-6-12)21-10-2-9-20-21/h1-10H,11H2