1-(4-methylsulfonylphenyl)-3-[(3-nitrophenoxy)methyl]-5-phenyl-pyrazole

Systemtic Name: 1-(4-methylsulfonylphenyl)-3-[(3-nitrophenoxy)methyl]-5-phenyl-pyrazole Openeye Name: 1-(4-methylsulfonylphenyl)-3-[(3-nitrophenoxy)methyl]-5-phenyl-pyrazole CAS Name: 1-(4-methylsulfonylphenyl)-3-[(3-nitrophenoxy)methyl]-5-phenylpyrazole IUPAC Name: 1-(4-methylsulfonylphenyl)-3-[(3-nitrophenoxy)methyl]-5-phenylpyrazole Traditional Name: 1-(4-mesylphenyl)-3-[(3-nitrophenoxy)methyl]-5-phenyl-pyrazole Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)COC3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)COC3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O5S/c1-32(29,30)22-12-10-19(11-13-22)25-23(17-6-3-2-4-7-17)14-18(24-25)16-31-21-9-5-8-20(15-21)26(27)28/h2-15H,16H2,1H3