(2-chlorophenyl)methyl 4-(4-bromanylpyrazol-1-yl)benzoate

Systemtic Name: (2-chlorophenyl)methyl 4-(4-bromanylpyrazol-1-yl)benzoate Openeye Name: (2-chlorophenyl)methyl 4-(4-bromopyrazol-1-yl)benzoate CAS Name: 4-(4-bromo-1-pyrazolyl)benzoic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 4-(4-bromopyrazol-1-yl)benzoate Traditional Name: 4-(4-bromopyrazol-1-yl)benzoic acid (2-chlorobenzyl) ester Formula: C17H12BrClN2O2 MolecularWeight: 391.64638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrClN2O2/c18-14-9-20-21(10-14)15-7-5-12(6-8-15)17(22)23-11-13-3-1-2-4-16(13)19/h1-10H,11H2