cyclohexa-1,5-dien-1-yl 4-methylbenzenesulfonate

Systemtic Name: cyclohexa-1,5-dien-1-yl 4-methylbenzenesulfonate Openeye Name: cyclohexa-1,5-dien-1-yl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-cyclohexa-1,5-dienyl ester IUPAC Name: cyclohexa-1,5-dien-1-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid cyclohexa-1,5-dien-1-yl ester Formula: C13H14O3S MolecularWeight: 250.31346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CCCC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CCCC=C2

InChI

InChI=1S/C13H14O3S/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12/h3,5-10H,2,4H2,1H3