[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 4-oxidanylidenepentanoate

Systemtic Name: [2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 4-oxidanylidenepentanoate Openeye Name: [2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [2-keto-2-(3-piperidinosulfonylanilino)ethyl] ester Formula: C18H24N2O6S MolecularWeight: 396.45796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O6S/c1-14(21)8-9-18(23)26-13-17(22)19-15-6-5-7-16(12-15)27(24,25)20-10-3-2-4-11-20/h5-7,12H,2-4,8-11,13H2,1H3,(H,19,22)