4-(3-bromophenyl)carbonyl-5-methyl-2-phenyl-pyrazol-3-olate

Systemtic Name: 4-(3-bromophenyl)carbonyl-5-methyl-2-phenyl-pyrazol-3-olate Openeye Name: 4-(3-bromobenzoyl)-5-methyl-2-phenyl-pyrazol-3-olate CAS Name: 4-[(3-bromophenyl)-oxomethyl]-5-methyl-2-phenyl-3-pyrazololate IUPAC Name: 4-(3-bromobenzoyl)-5-methyl-2-phenylpyrazol-3-olate Traditional Name: 4-(3-bromobenzoyl)-5-methyl-2-phenyl-pyrazol-3-olate Formula: C17H12BrN2O2- MolecularWeight: 356.19338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C2=CC(=CC=C2)Br)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)C2=CC(=CC=C2)Br)[O-])C3=CC=CC=C3

InChI

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