4-(5-methyl-2-phenyl-pyrazol-3-yl)oxysulfonylbenzoic acid

Systemtic Name: 4-(5-methyl-2-phenyl-pyrazol-3-yl)oxysulfonylbenzoic acid Openeye Name: 4-(5-methyl-2-phenyl-pyrazol-3-yl)oxysulfonylbenzoic acid CAS Name: 4-[(5-methyl-2-phenyl-3-pyrazolyl)oxysulfonyl]benzoic acid IUPAC Name: 4-(5-methyl-2-phenylpyrazol-3-yl)oxysulfonylbenzoic acid Traditional Name: 4-(5-methyl-2-phenyl-pyrazol-3-yl)oxysulfonylbenzoic acid Formula: C17H14N2O5S MolecularWeight: 358.36846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O5S/c1-12-11-16(19(18-12)14-5-3-2-4-6-14)24-25(22,23)15-9-7-13(8-10-15)17(20)21/h2-11H,1H3,(H,20,21)