1-[3-(4-fluoranylphenoxy)propylsulfonyl]piperidine-2,4-dicarboxylic acid

Systemtic Name: 1-[3-(4-fluoranylphenoxy)propylsulfonyl]piperidine-2,4-dicarboxylic acid Openeye Name: 1-[3-(4-fluorophenoxy)propylsulfonyl]piperidine-2,4-dicarboxylic acid CAS Name: 1-[3-(4-fluorophenoxy)propylsulfonyl]piperidine-2,4-dicarboxylic acid IUPAC Name: 1-[3-(4-fluorophenoxy)propylsulfonyl]piperidine-2,4-dicarboxylic acid Traditional Name: 1-[3-(4-fluorophenoxy)propylsulfonyl]piperidine-2,4-dicarboxylic acid Formula: C16H20FNO7S MolecularWeight: 389.395903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1C(=O)O)C(=O)O)S(=O)(=O)CCCOC2=CC=C(C=C2)F

Isomeric SMILES

C1CN(C(CC1C(=O)O)C(=O)O)S(=O)(=O)CCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C16H20FNO7S/c17-12-2-4-13(5-3-12)25-8-1-9-26(23,24)18-7-6-11(15(19)20)10-14(18)16(21)22/h2-5,11,14H,1,6-10H2,(H,19,20)(H,21,22)