methyl 2,2-dimethyl-3-methylsulfonyloxy-7-phenyl-heptanoate

Systemtic Name: methyl 2,2-dimethyl-3-methylsulfonyloxy-7-phenyl-heptanoate Openeye Name: methyl 2,2-dimethyl-3-methylsulfonyloxy-7-phenyl-heptanoate CAS Name: 2,2-dimethyl-3-methylsulfonyloxy-7-phenylheptanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-3-methylsulfonyloxy-7-phenylheptanoate Traditional Name: 2,2-dimethyl-3-methylsulfonyloxy-7-phenyl-enanthic acid methyl ester Formula: C17H26O5S MolecularWeight: 342.45034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O5S/c1-17(2,16(18)21-3)15(22-23(4,19)20)13-9-8-12-14-10-6-5-7-11-14/h5-7,10-11,15H,8-9,12-13H2,1-4H3