5-[(3-bromophenyl)methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[(3-bromophenyl)methyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[(3-bromophenyl)methyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[(3-bromophenyl)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[(3-bromophenyl)methyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-(3-bromobenzyl)-3-pyrazolin-3-one Formula: C10H9BrN2O MolecularWeight: 253.09526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CC2=CC(=O)NN2

Isomeric SMILES

C1=CC(=CC(=C1)Br)CC2=CC(=O)NN2

InChI

InChI=1S/C10H9BrN2O/c11-8-3-1-2-7(4-8)5-9-6-10(14)13-12-9/h1-4,6H,5H2,(H2,12,13,14)