(4S)-4-(4-bromophenyl)carbonyl-5-methyl-2-phenyl-4H-pyrazol-3-one

Systemtic Name: (4S)-4-(4-bromophenyl)carbonyl-5-methyl-2-phenyl-4H-pyrazol-3-one Openeye Name: (4S)-4-(4-bromobenzoyl)-5-methyl-2-phenyl-4H-pyrazol-3-one CAS Name: (4S)-4-[(4-bromophenyl)-oxomethyl]-5-methyl-2-phenyl-4H-pyrazol-3-one IUPAC Name: (4S)-4-(4-bromobenzoyl)-5-methyl-2-phenyl-4H-pyrazol-3-one Traditional Name: (4S)-4-(4-bromobenzoyl)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C17H13BrN2O2 MolecularWeight: 357.20132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@@H]1C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H13BrN2O2/c1-11-15(16(21)12-7-9-13(18)10-8-12)17(22)20(19-11)14-5-3-2-4-6-14/h2-10,15H,1H3/t15-/m0/s1