1-[3-(5-bromanyl-2-oxidanyl-phenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[3-(5-bromanyl-2-oxidanyl-phenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[3-(5-bromo-2-hydroxy-phenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[3-(5-bromo-2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[3-(5-bromo-2-hydroxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[5-(5-bromo-2-hydroxy-phenyl)-3-phenyl-2-pyrazolin-1-yl]ethanone Formula: C17H15BrN2O2 MolecularWeight: 359.2172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

CC(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C17H15BrN2O2/c1-11(21)20-16(14-9-13(18)7-8-17(14)22)10-15(19-20)12-5-3-2-4-6-12/h2-9,16,22H,10H2,1H3