[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] naphthalene-2-sulfonate

Systemtic Name: [2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] naphthalene-2-sulfonate Openeye Name: [5-phenyl-2-(p-tolyl)pyrazol-3-yl] naphthalene-2-sulfonate CAS Name: 2-naphthalenesulfonic acid [2-(4-methylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-phenylpyrazol-3-yl] naphthalene-2-sulfonate Traditional Name: naphthalene-2-sulfonic acid [5-phenyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C26H20N2O3S MolecularWeight: 440.5136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)OS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=C3)OS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H20N2O3S/c1-19-11-14-23(15-12-19)28-26(18-25(27-28)21-8-3-2-4-9-21)31-32(29,30)24-16-13-20-7-5-6-10-22(20)17-24/h2-18H,1H3