1-[5-(4-bromophenyl)-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[5-(4-bromophenyl)-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-phenoxy-ethanone CAS Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-phenoxyethanone IUPAC Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-phenoxyethanone Traditional Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-2-pyrazolin-1-yl]-2-phenoxy-ethanone Formula: C18H17BrN2O3 MolecularWeight: 389.24318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H17BrN2O3/c1-13-11-18(23,14-7-9-15(19)10-8-14)21(20-13)17(22)12-24-16-5-3-2-4-6-16/h2-10,23H,11-12H2,1H3