4-bromanyl-5-(hydroxymethyl)-1-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-bromanyl-5-(hydroxymethyl)-1-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-bromo-5-(hydroxymethyl)-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-bromo-5-(hydroxymethyl)-1-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-bromo-5-(hydroxymethyl)-1-methyl-2-phenylpyrazol-3-one Traditional Name: 4-bromo-1-methyl-5-methylol-2-phenyl-3-pyrazolin-3-one Formula: C11H11BrN2O2 MolecularWeight: 283.12124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CO

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CO

InChI

InChI=1S/C11H11BrN2O2/c1-13-9(7-15)10(12)11(16)14(13)8-5-3-2-4-6-8/h2-6,15H,7H2,1H3