6-(oxan-2-yloxy)hex-3-ynyl 4-methylbenzenesulfonate

Systemtic Name: 6-(oxan-2-yloxy)hex-3-ynyl 4-methylbenzenesulfonate Openeye Name: 6-tetrahydropyran-2-yloxyhex-3-ynyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 6-(2-oxanyloxy)hex-3-ynyl ester IUPAC Name: 6-(oxan-2-yloxy)hex-3-ynyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 6-tetrahydropyran-2-yloxyhex-3-ynyl ester Formula: C18H24O5S MolecularWeight: 352.44516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC#CCCOC2CCCCO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC#CCCOC2CCCCO2

InChI

InChI=1S/C18H24O5S/c1-16-9-11-17(12-10-16)24(19,20)23-15-6-3-2-5-13-21-18-8-4-7-14-22-18/h9-12,18H,4-8,13-15H2,1H3