4-(3-phenylpyrazol-1-yl)benzenesulfonic acid

Systemtic Name: 4-(3-phenylpyrazol-1-yl)benzenesulfonic acid Openeye Name: 4-(3-phenylpyrazol-1-yl)benzenesulfonic acid CAS Name: 4-(3-phenyl-1-pyrazolyl)benzenesulfonic acid IUPAC Name: 4-(3-phenylpyrazol-1-yl)benzenesulfonic acid Traditional Name: 4-(3-phenylpyrazol-1-yl)besylic acid Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2)C3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2)C3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C15H12N2O3S/c18-21(19,20)14-8-6-13(7-9-14)17-11-10-15(16-17)12-4-2-1-3-5-12/h1-11H,(H,18,19,20)