2-(4-bromophenyl)-5-methyl-4-propan-2-ylidene-pyrazol-3-one

Systemtic Name: 2-(4-bromophenyl)-5-methyl-4-propan-2-ylidene-pyrazol-3-one Openeye Name: 2-(4-bromophenyl)-4-isopropylidene-5-methyl-pyrazol-3-one CAS Name: 2-(4-bromophenyl)-5-methyl-4-propan-2-ylidene-3-pyrazolone IUPAC Name: 2-(4-bromophenyl)-5-methyl-4-propan-2-ylidenepyrazol-3-one Traditional Name: 2-(4-bromophenyl)-4-isopropylidene-5-methyl-2-pyrazolin-3-one Formula: C13H13BrN2O MolecularWeight: 293.15912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN2O/c1-8(2)12-9(3)15-16(13(12)17)11-6-4-10(14)5-7-11/h4-7H,1-3H3