9-borabicyclo[3.3.1]nonan-9-yl 4-methylbenzenesulfonate

Systemtic Name: 9-borabicyclo[3.3.1]nonan-9-yl 4-methylbenzenesulfonate Openeye Name: 9-borabicyclo[3.3.1]nonan-9-yl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 9-borabicyclo[3.3.1]nonan-9-yl ester IUPAC Name: 9-borabicyclo[3.3.1]nonan-9-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 9-borabicyclo[3.3.1]nonan-9-yl ester Formula: C15H21BO3S MolecularWeight: 292.20144

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2CCCC1CCC2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

B1(C2CCCC1CCC2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C15H21BO3S/c1-12-8-10-15(11-9-12)20(17,18)19-16-13-4-2-5-14(16)7-3-6-13/h8-11,13-14H,2-7H2,1H3