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

Systemtic Name: 2-[1-(3-bromanyl-4-chloranyl-phenyl)ethyl]-5-methyl-1H-pyrazol-3-one Openeye Name: 2-[1-(3-bromo-4-chloro-phenyl)ethyl]-5-methyl-1H-pyrazol-3-one CAS Name: 2-[1-(3-bromo-4-chlorophenyl)ethyl]-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-[1-(3-bromo-4-chlorophenyl)ethyl]-5-methyl-1H-pyrazol-3-one Traditional Name: 2-[1-(3-bromo-4-chloro-phenyl)ethyl]-5-methyl-3-pyrazolin-3-one Formula: C12H12BrClN2O MolecularWeight: 315.59348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C(C)C2=CC(=C(C=C2)Cl)Br

Isomeric SMILES

CC1=CC(=O)N(N1)C(C)C2=CC(=C(C=C2)Cl)Br

InChI

InChI=1S/C12H12BrClN2O/c1-7-5-12(17)16(15-7)8(2)9-3-4-11(14)10(13)6-9/h3-6,8,15H,1-2H3