2-[4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)pyrazol-1-yl]ethanoate

Systemtic Name: 2-[4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)pyrazol-1-yl]ethanoate Openeye Name: 2-[3-(4-methylsulfonylphenyl)-4-(p-tolyl)pyrazol-1-yl]acetate CAS Name: 2-[4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-pyrazolyl]acetate IUPAC Name: 2-[4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)pyrazol-1-yl]acetate Traditional Name: 2-[3-(4-mesylphenyl)-4-(p-tolyl)pyrazol-1-yl]acetate Formula: C19H17N2O4S- MolecularWeight: 369.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CC(=O)[O-]

InChI

InChI=1S/C19H18N2O4S/c1-13-3-5-14(6-4-13)17-11-21(12-18(22)23)20-19(17)15-7-9-16(10-8-15)26(2,24)25/h3-11H,12H2,1-2H3,(H,22,23)/p-1