2-(3-bromophenyl)-5-methyl-4H-pyrazol-3-one

Systemtic Name: 2-(3-bromophenyl)-5-methyl-4H-pyrazol-3-one Openeye Name: 2-(3-bromophenyl)-5-methyl-4H-pyrazol-3-one CAS Name: 2-(3-bromophenyl)-5-methyl-4H-pyrazol-3-one IUPAC Name: 2-(3-bromophenyl)-5-methyl-4H-pyrazol-3-one Traditional Name: 2-(3-bromophenyl)-5-methyl-2-pyrazolin-3-one Formula: C10H9BrN2O MolecularWeight: 253.09526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9BrN2O/c1-7-5-10(14)13(12-7)9-4-2-3-8(11)6-9/h2-4,6H,5H2,1H3