2-[1-(4-bromanyl-3-chloranyl-phenyl)ethyl]-5-ethyl-1H-pyrazol-3-one

Systemtic Name: 2-[1-(4-bromanyl-3-chloranyl-phenyl)ethyl]-5-ethyl-1H-pyrazol-3-one Openeye Name: 2-[1-(4-bromo-3-chloro-phenyl)ethyl]-5-ethyl-1H-pyrazol-3-one CAS Name: 2-[1-(4-bromo-3-chlorophenyl)ethyl]-5-ethyl-1H-pyrazol-3-one IUPAC Name: 2-[1-(4-bromo-3-chlorophenyl)ethyl]-5-ethyl-1H-pyrazol-3-one Traditional Name: 2-[1-(4-bromo-3-chloro-phenyl)ethyl]-5-ethyl-3-pyrazolin-3-one Formula: C13H14BrClN2O MolecularWeight: 329.62006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N(N1)C(C)C2=CC(=C(C=C2)Br)Cl

Isomeric SMILES

CCC1=CC(=O)N(N1)C(C)C2=CC(=C(C=C2)Br)Cl

InChI

InChI=1S/C13H14BrClN2O/c1-3-10-7-13(18)17(16-10)8(2)9-4-5-11(14)12(15)6-9/h4-8,16H,3H2,1-2H3