(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 2-bromanylbenzoate

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 2-bromanylbenzoate Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C19H17BrN2O2 MolecularWeight: 385.25448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)COC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)COC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C19H17BrN2O2/c1-13-17(12-24-19(23)16-10-6-7-11-18(16)20)14(2)22(21-13)15-8-4-3-5-9-15/h3-11H,12H2,1-2H3