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(5-methyl-2-phenyl-pyrazol-3-yl) 4-tert-butylbenzenesulfonate

(5-methyl-2-phenyl-pyrazol-3-yl) 4-tert-butylbenzenesulfonate

Systemtic Name:(5-methyl-2-phenyl-pyrazol-3-yl) 4-tert-butylbenzenesulfonate
Openeye Name:(5-methyl-2-phenyl-pyrazol-3-yl) 4-tert-butylbenzenesulfonate
CAS Name:4-tert-butylbenzenesulfonic acid (5-methyl-2-phenyl-3-pyrazolyl) ester
IUPAC Name:(5-methyl-2-phenylpyrazol-3-yl) 4-tert-butylbenzenesulfonate
Traditional Name:4-tert-butylbenzenesulfonic acid (5-methyl-2-phenyl-pyrazol-3-yl) ester
Formula: C20H22N2O3S
MolecularWeight: 370.46528
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C20H22N2O3S/c1-15-14-19(22(21-15)17-8-6-5-7-9-17)25-26(23,24)18-12-10-16(11-13-18)20(2,3)4/h5-14H,1-4H3


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