methyl (2S)-6,6,7,7,8,8,9,9,10,10,11,11,11-tridecakis(fluoranyl)-4-iodanyl-2-[(4-methylphenyl)sulfonylamino]undecanoate

Systemtic Name: methyl (2S)-6,6,7,7,8,8,9,9,10,10,11,11,11-tridecakis(fluoranyl)-4-iodanyl-2-[(4-methylphenyl)sulfonylamino]undecanoate Openeye Name: methyl (2S)-6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoro-4-iodo-2-(p-tolylsulfonylamino)undecanoate CAS Name: (2S)-6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoro-4-iodo-2-[(4-methylphenyl)sulfonylamino]undecanoic acid methyl ester IUPAC Name: methyl (2S)-6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoro-4-iodo-2-[(4-methylphenyl)sulfonylamino]undecanoate Traditional Name: (2S)-6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoro-4-iodo-2-(tosylamino)undecanoic acid methyl ester Formula: C19H17F13INO4S MolecularWeight: 729.291292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I)C(=O)OC

InChI

InChI=1S/C19H17F13INO4S/c1-9-3-5-11(6-4-9)39(36,37)34-12(13(35)38-2)7-10(33)8-14(20,21)15(22,23)16(24,25)17(26,27)18(28,29)19(30,31)32/h3-6,10,12,34H,7-8H2,1-2H3/t10?,12-/m0/s1