[(3R,4R)-1-cyano-4-methyl-6-phenylmethoxy-hexan-3-yl] methanesulfonate

Systemtic Name: [(3R,4R)-1-cyano-4-methyl-6-phenylmethoxy-hexan-3-yl] methanesulfonate Openeye Name: [(1R,2R)-4-benzyloxy-1-(2-cyanoethyl)-2-methyl-butyl] methanesulfonate CAS Name: methanesulfonic acid [(3R,4R)-1-cyano-4-methyl-6-phenylmethoxyhexan-3-yl] ester IUPAC Name: [(3R,4R)-1-cyano-4-methyl-6-phenylmethoxyhexan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R,2R)-4-benzoxy-1-(2-cyanoethyl)-2-methyl-butyl] ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOCC1=CC=CC=C1)C(CCC#N)OS(=O)(=O)C

Isomeric SMILES

C[C@H](CCOCC1=CC=CC=C1)[C@@H](CCC#N)OS(=O)(=O)C

InChI

InChI=1S/C16H23NO4S/c1-14(16(9-6-11-17)21-22(2,18)19)10-12-20-13-15-7-4-3-5-8-15/h3-5,7-8,14,16H,6,9-10,12-13H2,1-2H3/t14-,16-/m1/s1