2-(3-bromophenyl)-5-propan-2-yl-4H-pyrazol-3-one

Systemtic Name: 2-(3-bromophenyl)-5-propan-2-yl-4H-pyrazol-3-one Openeye Name: 2-(3-bromophenyl)-5-isopropyl-4H-pyrazol-3-one CAS Name: 2-(3-bromophenyl)-5-propan-2-yl-4H-pyrazol-3-one IUPAC Name: 2-(3-bromophenyl)-5-propan-2-yl-4H-pyrazol-3-one Traditional Name: 2-(3-bromophenyl)-5-isopropyl-2-pyrazolin-3-one Formula: C12H13BrN2O MolecularWeight: 281.14842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrN2O/c1-8(2)11-7-12(16)15(14-11)10-5-3-4-9(13)6-10/h3-6,8H,7H2,1-2H3