3-phenylpropyl 5-fluoranyl-2-(2-methoxyethoxy)benzenesulfonate

Systemtic Name: 3-phenylpropyl 5-fluoranyl-2-(2-methoxyethoxy)benzenesulfonate Openeye Name: 3-phenylpropyl 5-fluoro-2-(2-methoxyethoxy)benzenesulfonate CAS Name: 5-fluoro-2-(2-methoxyethoxy)benzenesulfonic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-fluoro-2-(2-methoxyethoxy)benzenesulfonate Traditional Name: 5-fluoro-2-(2-methoxyethoxy)benzenesulfonic acid 3-phenylpropyl ester Formula: C18H21FO5S MolecularWeight: 368.419743

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)F)S(=O)(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

COCCOC1=C(C=C(C=C1)F)S(=O)(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C18H21FO5S/c1-22-12-13-23-17-10-9-16(19)14-18(17)25(20,21)24-11-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-10,14H,5,8,11-13H2,1H3