[3-(furan-2-yl)-2-methyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [3-(furan-2-yl)-2-methyl-propyl] 4-methylbenzenesulfonate Openeye Name: [3-(2-furyl)-2-methyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(2-furanyl)-2-methylpropyl] ester IUPAC Name: [3-(furan-2-yl)-2-methylpropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(2-furyl)-2-methyl-propyl] ester Formula: C15H18O4S MolecularWeight: 294.36602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)CC2=CC=CO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)CC2=CC=CO2

InChI

InChI=1S/C15H18O4S/c1-12-5-7-15(8-6-12)20(16,17)19-11-13(2)10-14-4-3-9-18-14/h3-9,13H,10-11H2,1-2H3