[(5R,6S)-6-benzamido-2,2-dimethyl-1,3-dioxepan-5-yl] methanesulfonate

Systemtic Name: [(5R,6S)-6-benzamido-2,2-dimethyl-1,3-dioxepan-5-yl] methanesulfonate Openeye Name: [(5R,6S)-6-benzamido-2,2-dimethyl-1,3-dioxepan-5-yl] methanesulfonate CAS Name: methanesulfonic acid [(5R,6S)-6-benzamido-2,2-dimethyl-1,3-dioxepan-5-yl] ester IUPAC Name: [(5R,6S)-6-benzamido-2,2-dimethyl-1,3-dioxepan-5-yl] methanesulfonate Traditional Name: methanesulfonic acid [(5R,6S)-6-benzamido-2,2-dimethyl-1,3-dioxepan-5-yl] ester Formula: C15H21NO6S MolecularWeight: 343.39534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(CO1)OS(=O)(=O)C)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(OC[C@@H]([C@H](CO1)OS(=O)(=O)C)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C15H21NO6S/c1-15(2)20-9-12(13(10-21-15)22-23(3,18)19)16-14(17)11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H,16,17)/t12-,13-/m0/s1