5-(3,4-dimethoxy-5-nitro-phenyl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-(3,4-dimethoxy-5-nitro-phenyl)-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-(3,4-dimethoxy-5-nitro-phenyl)-2-phenyl-4H-pyrazol-3-one CAS Name: 5-(3,4-dimethoxy-5-nitrophenyl)-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-(3,4-dimethoxy-5-nitrophenyl)-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-(3,4-dimethoxy-5-nitro-phenyl)-2-phenyl-2-pyrazolin-3-one Formula: C17H15N3O5 MolecularWeight: 341.3181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C2=NN(C(=O)C2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C2=NN(C(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O5/c1-24-15-9-11(8-14(20(22)23)17(15)25-2)13-10-16(21)19(18-13)12-6-4-3-5-7-12/h3-9H,10H2,1-2H3