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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C2=CC=CC=C2Br)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)C2=CC=CC=C2Br)[O-])C3=CC=CC=C3

InChI

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