3-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylidene]pentane-2,4-dione

Systemtic Name: 3-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylidene]pentane-2,4-dione Openeye Name: 3-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylene]pentane-2,4-dione CAS Name: 3-[[3-(4-bromophenyl)-1-phenyl-4-pyrazolyl]methylidene]pentane-2,4-dione IUPAC Name: 3-[[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]methylidene]pentane-2,4-dione Traditional Name: 3-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylene]pentane-2,4-dione Formula: C21H17BrN2O2 MolecularWeight: 409.27588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)Br)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)Br)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H17BrN2O2/c1-14(25)20(15(2)26)12-17-13-24(19-6-4-3-5-7-19)23-21(17)16-8-10-18(22)11-9-16/h3-13H,1-2H3