1-[5-(4-bromophenyl)-3-ethyl-5-oxidanyl-4H-pyrazol-1-yl]propan-1-one

Systemtic Name: 1-[5-(4-bromophenyl)-3-ethyl-5-oxidanyl-4H-pyrazol-1-yl]propan-1-one Openeye Name: 1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]propan-1-one CAS Name: 1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]-1-propanone IUPAC Name: 1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]propan-1-one Traditional Name: 1-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-2-pyrazolin-1-yl]propan-1-one Formula: C14H17BrN2O2 MolecularWeight: 325.20098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)CC

Isomeric SMILES

CCC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)CC

InChI

InChI=1S/C14H17BrN2O2/c1-3-12-9-14(19,17(16-12)13(18)4-2)10-5-7-11(15)8-6-10/h5-8,19H,3-4,9H2,1-2H3