(5-methyl-2-phenyl-pyrazol-3-yl) 3-bromanylbenzoate

Systemtic Name: (5-methyl-2-phenyl-pyrazol-3-yl) 3-bromanylbenzoate Openeye Name: (5-methyl-2-phenyl-pyrazol-3-yl) 3-bromobenzoate CAS Name: 3-bromobenzoic acid (5-methyl-2-phenyl-3-pyrazolyl) ester IUPAC Name: (5-methyl-2-phenylpyrazol-3-yl) 3-bromobenzoate Traditional Name: 3-bromobenzoic acid (5-methyl-2-phenyl-pyrazol-3-yl) ester Formula: C17H13BrN2O2 MolecularWeight: 357.20132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OC(=O)C2=CC(=CC=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1)OC(=O)C2=CC(=CC=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H13BrN2O2/c1-12-10-16(20(19-12)15-8-3-2-4-9-15)22-17(21)13-6-5-7-14(18)11-13/h2-11H,1H3