5-[4-(4-bromophenyl)phenyl]-5-methyl-pyrazolidin-3-one

Systemtic Name: 5-[4-(4-bromophenyl)phenyl]-5-methyl-pyrazolidin-3-one Openeye Name: 5-[4-(4-bromophenyl)phenyl]-5-methyl-pyrazolidin-3-one CAS Name: 5-[4-(4-bromophenyl)phenyl]-5-methyl-3-pyrazolidinone IUPAC Name: 5-[4-(4-bromophenyl)phenyl]-5-methylpyrazolidin-3-one Traditional Name: 5-[4-(4-bromophenyl)phenyl]-5-methyl-pyrazolidin-3-one Formula: C16H15BrN2O MolecularWeight: 331.2071

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)NN1)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1(CC(=O)NN1)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H15BrN2O/c1-16(10-15(20)18-19-16)13-6-2-11(3-7-13)12-4-8-14(17)9-5-12/h2-9,19H,10H2,1H3,(H,18,20)