methyl (E)-3-(fluoranylmethyl)-4-(4-methylphenyl)sulfinyl-but-2-enoate

Systemtic Name: methyl (E)-3-(fluoranylmethyl)-4-(4-methylphenyl)sulfinyl-but-2-enoate Openeye Name: methyl (E)-3-(fluoromethyl)-4-(p-tolylsulfinyl)but-2-enoate CAS Name: (E)-3-(fluoromethyl)-4-(4-methylphenyl)sulfinyl-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-(fluoromethyl)-4-(4-methylphenyl)sulfinylbut-2-enoate Traditional Name: (E)-3-(fluoromethyl)-4-(p-tolylsulfinyl)but-2-enoic acid methyl ester Formula: C13H15FO3S MolecularWeight: 270.319803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CC(=CC(=O)OC)CF

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)C/C(=C/C(=O)OC)/CF

InChI

InChI=1S/C13H15FO3S/c1-10-3-5-12(6-4-10)18(16)9-11(8-14)7-13(15)17-2/h3-7H,8-9H2,1-2H3/b11-7+