1-(5-bromanyl-2-oxidanyl-phenyl)-3-(2-methyl-5-propyl-pyrazol-3-yl)propane-1,3-dione

Systemtic Name: 1-(5-bromanyl-2-oxidanyl-phenyl)-3-(2-methyl-5-propyl-pyrazol-3-yl)propane-1,3-dione Openeye Name: 1-(5-bromo-2-hydroxy-phenyl)-3-(2-methyl-5-propyl-pyrazol-3-yl)propane-1,3-dione CAS Name: 1-(5-bromo-2-hydroxyphenyl)-3-(2-methyl-5-propyl-3-pyrazolyl)propane-1,3-dione IUPAC Name: 1-(5-bromo-2-hydroxyphenyl)-3-(2-methyl-5-propylpyrazol-3-yl)propane-1,3-dione Traditional Name: 1-(5-bromo-2-hydroxy-phenyl)-3-(2-methyl-5-propyl-pyrazol-3-yl)propane-1,3-dione Formula: C16H17BrN2O3 MolecularWeight: 365.22178

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)C(=O)CC(=O)C2=C(C=CC(=C2)Br)O)C

Isomeric SMILES

CCCC1=NN(C(=C1)C(=O)CC(=O)C2=C(C=CC(=C2)Br)O)C

InChI

InChI=1S/C16H17BrN2O3/c1-3-4-11-8-13(19(2)18-11)16(22)9-15(21)12-7-10(17)5-6-14(12)20/h5-8,20H,3-4,9H2,1-2H3