2-(3-bromophenyl)-5-methyl-4-[(3-nitrophenyl)methylidene]pyrazol-3-one

Systemtic Name: 2-(3-bromophenyl)-5-methyl-4-[(3-nitrophenyl)methylidene]pyrazol-3-one Openeye Name: 2-(3-bromophenyl)-5-methyl-4-[(3-nitrophenyl)methylene]pyrazol-3-one CAS Name: 2-(3-bromophenyl)-5-methyl-4-[(3-nitrophenyl)methylidene]-3-pyrazolone IUPAC Name: 2-(3-bromophenyl)-5-methyl-4-[(3-nitrophenyl)methylidene]pyrazol-3-one Traditional Name: 2-(3-bromophenyl)-5-methyl-4-(3-nitrobenzylidene)-2-pyrazolin-3-one Formula: C17H12BrN3O3 MolecularWeight: 386.19948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=NN(C(=O)C1=CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H12BrN3O3/c1-11-16(9-12-4-2-7-15(8-12)21(23)24)17(22)20(19-11)14-6-3-5-13(18)10-14/h2-10H,1H3