[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl] 4-oxidanylidenepentanoate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl] 4-oxidanylidenepentanoate Openeye Name: [2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [2-keto-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C18H24N2O6S MolecularWeight: 396.45796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(=O)CCC(=O)OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H24N2O6S/c1-14(21)5-10-18(23)26-13-17(22)19-15-6-8-16(9-7-15)27(24,25)20-11-3-2-4-12-20/h6-9H,2-5,10-13H2,1H3,(H,19,22)