methyl 4-[[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]benzenesulfonate

Systemtic Name: methyl 4-[[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]benzenesulfonate Openeye Name: methyl 4-[[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]benzenesulfonate CAS Name: 4-[[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]benzenesulfonic acid methyl ester IUPAC Name: methyl 4-[[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]benzenesulfonate Traditional Name: 4-[(2,2-dimethyl-5-methylol-1,3-dioxolan-4-yl)methyl]benzenesulfonic acid methyl ester Formula: C14H20O6S MolecularWeight: 316.37

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(C(O1)CO)CC2=CC=C(C=C2)S(=O)(=O)OC)C

Isomeric SMILES

CC1(OC(C(O1)CO)CC2=CC=C(C=C2)S(=O)(=O)OC)C

InChI

InChI=1S/C14H20O6S/c1-14(2)19-12(13(9-15)20-14)8-10-4-6-11(7-5-10)21(16,17)18-3/h4-7,12-13,15H,8-9H2,1-3H3