[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 3-(4-fluorophenyl)sulfonylpropanoate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 3-(4-fluorophenyl)sulfonylpropanoate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 3-(4-fluorophenyl)sulfonylpropanoate CAS Name: 3-(4-fluorophenyl)sulfonylpropanoic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 3-(4-fluorophenyl)sulfonylpropanoate Traditional Name: 3-(4-fluorophenyl)sulfonylpropionic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H22FNO5S MolecularWeight: 359.412983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)CCS(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C(=O)NC(C)(C)C)OC(=O)CCS(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C16H22FNO5S/c1-11(15(20)18-16(2,3)4)23-14(19)9-10-24(21,22)13-7-5-12(17)6-8-13/h5-8,11H,9-10H2,1-4H3,(H,18,20)