methyl 6-[[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[1-(4-fluorophenyl)sulfonylpiperidine-3-carbonyl]amino]hexanoate CAS Name: 6-[[[1-(4-fluorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[1-(4-fluorophenyl)sulfonylpiperidine-3-carbonyl]amino]hexanoate Traditional Name: 6-[[1-(4-fluorophenyl)sulfonylnipecotoyl]amino]hexanoic acid methyl ester Formula: C19H27FN2O5S MolecularWeight: 414.491483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H27FN2O5S/c1-27-18(23)7-3-2-4-12-21-19(24)15-6-5-13-22(14-15)28(25,26)17-10-8-16(20)9-11-17/h8-11,15H,2-7,12-14H2,1H3,(H,21,24)