[(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-oxidanyl-pent-3-ynyl] benzenesulfonate

Systemtic Name: [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-oxidanyl-pent-3-ynyl] benzenesulfonate Openeye Name: [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-hydroxy-pent-3-ynyl] benzenesulfonate CAS Name: benzenesulfonic acid [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-hydroxypent-3-ynyl] ester IUPAC Name: [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-hydroxypent-3-ynyl] benzenesulfonate Traditional Name: benzenesulfonic acid [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-hydroxy-pent-3-ynyl] ester Formula: C16H20O6S MolecularWeight: 340.3914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C(CC#CCO)OS(=O)(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(OC[C@H](O1)[C@H](CC#CCO)OS(=O)(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H20O6S/c1-16(2)20-12-15(21-16)14(10-6-7-11-17)22-23(18,19)13-8-4-3-5-9-13/h3-5,8-9,14-15,17H,10-12H2,1-2H3/t14-,15-/m0/s1