[(3S)-2,2-dimethyl-8-phenyl-oct-4-yn-3-yl] methanesulfonate

Systemtic Name: [(3S)-2,2-dimethyl-8-phenyl-oct-4-yn-3-yl] methanesulfonate Openeye Name: [(1S)-1-tert-butyl-6-phenyl-hex-2-ynyl] methanesulfonate CAS Name: methanesulfonic acid [(3S)-2,2-dimethyl-8-phenyloct-4-yn-3-yl] ester IUPAC Name: [(3S)-2,2-dimethyl-8-phenyloct-4-yn-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1S)-1-tert-butyl-6-phenyl-hex-2-ynyl] ester Formula: C17H24O3S MolecularWeight: 308.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C#CCCCC1=CC=CC=C1)OS(=O)(=O)C

Isomeric SMILES

CC(C)(C)[C@@H](C#CCCCC1=CC=CC=C1)OS(=O)(=O)C

InChI

InChI=1S/C17H24O3S/c1-17(2,3)16(20-21(4,18)19)14-10-6-9-13-15-11-7-5-8-12-15/h5,7-8,11-12,16H,6,9,13H2,1-4H3/t16-/m1/s1