[(1R,4S,6S)-4-acetyloxy-6-methylsulfonyloxy-cyclohept-2-en-1-yl] benzoate

Systemtic Name: [(1R,4S,6S)-4-acetyloxy-6-methylsulfonyloxy-cyclohept-2-en-1-yl] benzoate Openeye Name: [(1R,4S,6S)-4-acetoxy-6-methylsulfonyloxy-cyclohept-2-en-1-yl] benzoate CAS Name: benzoic acid [(1R,4S,6S)-4-acetyloxy-6-methylsulfonyloxy-1-cyclohept-2-enyl] ester IUPAC Name: [(1R,4S,6S)-4-acetyloxy-6-methylsulfonyloxycyclohept-2-en-1-yl] benzoate Traditional Name: benzoic acid [(1R,4S,6S)-4-acetoxy-6-methylsulfonyloxy-cyclohept-2-en-1-yl] ester Formula: C17H20O7S MolecularWeight: 368.4015

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(CC(C=C1)OC(=O)C2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CC(=O)O[C@H]1C[C@@H](C[C@H](C=C1)OC(=O)C2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C17H20O7S/c1-12(18)22-14-8-9-15(11-16(10-14)24-25(2,20)21)23-17(19)13-6-4-3-5-7-13/h3-9,14-16H,10-11H2,1-2H3/t14-,15+,16+/m1/s1