4-(2-bromanylpropanoyl)-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-(2-bromanylpropanoyl)-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-(2-bromopropanoyl)-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-(2-bromo-1-oxopropyl)-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-(2-bromopropanoyl)-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-(2-bromopropanoyl)-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C14H15BrN2O2 MolecularWeight: 323.1851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(=O)C(C)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(=O)C(C)Br

InChI

InChI=1S/C14H15BrN2O2/c1-9(15)13(18)12-10(2)16(3)17(14(12)19)11-7-5-4-6-8-11/h4-9H,1-3H3