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

Systemtic Name: 1-[5-(4-bromophenyl)-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-phenylethanone IUPAC Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-phenylethanone Traditional Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-methyl-2-pyrazolin-1-yl]-2-phenyl-ethanone Formula: C18H17BrN2O2 MolecularWeight: 373.24378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H17BrN2O2/c1-13-12-18(23,15-7-9-16(19)10-8-15)21(20-13)17(22)11-14-5-3-2-4-6-14/h2-10,23H,11-12H2,1H3