[(3R,4S)-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfonyloxy-hex-5-en-3-yl] methanesulfonate

Systemtic Name: [(3R,4S)-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfonyloxy-hex-5-en-3-yl] methanesulfonate Openeye Name: [(1R,2S)-2-methylsulfonyloxy-1-[2-(p-tolylsulfonylamino)ethyl]but-3-enyl] methanesulfonate CAS Name: methanesulfonic acid [(3R,4S)-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfonyloxyhex-5-en-3-yl] ester IUPAC Name: [(3R,4S)-1-[(4-methylphenyl)sulfonylamino]-4-methylsulfonyloxyhex-5-en-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R,2S)-2-methylsulfonyloxy-1-[2-(tosylamino)ethyl]but-3-enyl] ester Formula: C15H23NO8S3 MolecularWeight: 441.54002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(C(C=C)OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[C@H]([C@H](C=C)OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C15H23NO8S3/c1-5-14(23-25(3,17)18)15(24-26(4,19)20)10-11-16-27(21,22)13-8-6-12(2)7-9-13/h5-9,14-16H,1,10-11H2,2-4H3/t14-,15+/m0/s1