[2-[1-(4-methylphenyl)pyrazol-4-yl]carbonylphenyl] benzenesulfonate

Systemtic Name: [2-[1-(4-methylphenyl)pyrazol-4-yl]carbonylphenyl] benzenesulfonate Openeye Name: [2-[1-(p-tolyl)pyrazole-4-carbonyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-[[1-(4-methylphenyl)-4-pyrazolyl]-oxomethyl]phenyl] ester IUPAC Name: [2-[1-(4-methylphenyl)pyrazole-4-carbonyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[1-(p-tolyl)pyrazole-4-carbonyl]phenyl] ester Formula: C23H18N2O4S MolecularWeight: 418.46502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C=N2)C(=O)C3=CC=CC=C3OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C=N2)C(=O)C3=CC=CC=C3OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O4S/c1-17-11-13-19(14-12-17)25-16-18(15-24-25)23(26)21-9-5-6-10-22(21)29-30(27,28)20-7-3-2-4-8-20/h2-16H,1H3