3-fluoranylpropyl 4-methylbenzenesulfonate

Systemtic Name: 3-fluoranylpropyl 4-methylbenzenesulfonate Openeye Name: 3-fluoropropyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-fluoropropyl ester IUPAC Name: 3-fluoropropyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-fluoropropyl ester Formula: C10H13FO3S MolecularWeight: 232.271823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCF

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCF

InChI

InChI=1S/C10H13FO3S/c1-9-3-5-10(6-4-9)15(12,13)14-8-2-7-11/h3-6H,2,7-8H2,1H3