[(3Z)-6-fluoranyl-2-methyl-3-(oxidanylmethylidene)inden-1-yl] 2,2-dimethylpropane-1-sulfonate

Systemtic Name: [(3Z)-6-fluoranyl-2-methyl-3-(oxidanylmethylidene)inden-1-yl] 2,2-dimethylpropane-1-sulfonate Openeye Name: [(3Z)-6-fluoro-3-(hydroxymethylene)-2-methyl-inden-1-yl] 2,2-dimethylpropane-1-sulfonate CAS Name: 2,2-dimethyl-1-propanesulfonic acid IUPAC Name: [(3Z)-6-fluoro-3-(hydroxymethylidene)-2-methylinden-1-yl] 2,2-dimethylpropane-1-sulfonate Traditional Name: 2,2-dimethylpropane-1-sulfonic acid [(3Z)-6-fluoro-3-(hydroxymethylene)-2-methyl-inden-1-yl] ester Formula: C16H19FO4S MolecularWeight: 326.383063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CO)C=CC(=C2)F)OS(=O)(=O)CC(C)(C)C

Isomeric SMILES

CC\1=C(C2=C(/C1=C/O)C=CC(=C2)F)OS(=O)(=O)CC(C)(C)C

InChI

InChI=1S/C16H19FO4S/c1-10-14(8-18)12-6-5-11(17)7-13(12)15(10)21-22(19,20)9-16(2,3)4/h5-8,18H,9H2,1-4H3/b14-8+