3-(4-fluoranylphenoxy)propyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: 3-(4-fluorophenoxy)propyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid 3-(4-fluorophenoxy)propyl ester Formula: C18H19FO5S MolecularWeight: 366.403863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCCCOC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C18H19FO5S/c1-13-4-9-16(25(2,21)22)12-17(13)18(20)24-11-3-10-23-15-7-5-14(19)6-8-15/h4-9,12H,3,10-11H2,1-2H3