[5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] naphthalene-1-sulfonate

Systemtic Name: [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] naphthalene-1-sulfonate Openeye Name: [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid [5-ethyl-2-(4-fluorophenyl)-3-pyrazolyl] ester IUPAC Name: [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] ester Formula: C21H17FN2O3S MolecularWeight: 396.434683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=NN(C(=C1)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN2O3S/c1-2-17-14-21(24(23-17)18-12-10-16(22)11-13-18)27-28(25,26)20-9-5-7-15-6-3-4-8-19(15)20/h3-14H,2H2,1H3