5-methyl-4-(4-methylsulfonylphenoxy)-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-methyl-4-(4-methylsulfonylphenoxy)-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-methyl-4-(4-methylsulfonylphenoxy)-2-phenyl-1H-pyrazol-3-one CAS Name: 5-methyl-4-(4-methylsulfonylphenoxy)-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-methyl-4-(4-methylsulfonylphenoxy)-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-(4-mesylphenoxy)-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)OC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)OC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H16N2O4S/c1-12-16(17(20)19(18-12)13-6-4-3-5-7-13)23-14-8-10-15(11-9-14)24(2,21)22/h3-11,18H,1-2H3