5-(4-nitrophenyl)-2-(phenylsulfonyl)-4H-pyrazol-3-one

Systemtic Name: 5-(4-nitrophenyl)-2-(phenylsulfonyl)-4H-pyrazol-3-one Openeye Name: 2-(benzenesulfonyl)-5-(4-nitrophenyl)-4H-pyrazol-3-one CAS Name: 2-(benzenesulfonyl)-5-(4-nitrophenyl)-4H-pyrazol-3-one IUPAC Name: 2-(benzenesulfonyl)-5-(4-nitrophenyl)-4H-pyrazol-3-one Traditional Name: 2-besyl-5-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(=NN(C1=O)S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O5S/c19-15-10-14(11-6-8-12(9-7-11)18(20)21)16-17(15)24(22,23)13-4-2-1-3-5-13/h1-9H,10H2