(3-bromophenyl)-(3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl)methanone

Systemtic Name: (3-bromophenyl)-(3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl)methanone Openeye Name: (3-bromophenyl)-[5-hydroxy-3-methyl-5-(3-pyridyl)-4H-pyrazol-1-yl]methanone CAS Name: (3-bromophenyl)-[5-hydroxy-3-methyl-5-(3-pyridinyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (3-bromophenyl)-(5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)methanone Traditional Name: (3-bromophenyl)-[5-hydroxy-3-methyl-5-(3-pyridyl)-2-pyrazolin-1-yl]methanone Formula: C16H14BrN3O2 MolecularWeight: 360.20526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3O2/c1-11-9-16(22,13-5-3-7-18-10-13)20(19-11)15(21)12-4-2-6-14(17)8-12/h2-8,10,22H,9H2,1H3