2-(2-fluoranylphenoxy)ethyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 2-(2-fluorophenoxy)ethyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxylic acid 2-(2-fluorophenoxy)ethyl ester IUPAC Name: 2-(2-fluorophenoxy)ethyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-mesitylsulfonylisonipecotic acid 2-(2-fluorophenoxy)ethyl ester Formula: C23H28FNO5S MolecularWeight: 449.535523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)OCCOC3=CC=CC=C3F)C

InChI

InChI=1S/C23H28FNO5S/c1-16-14-17(2)22(18(3)15-16)31(27,28)25-10-8-19(9-11-25)23(26)30-13-12-29-21-7-5-4-6-20(21)24/h4-7,14-15,19H,8-13H2,1-3H3