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

Systemtic Name: [2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 4-oxidanylidenepentanoate Openeye Name: [2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl] ester Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(=O)CCC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C17H22N2O6S/c1-13(20)7-8-17(22)25-12-16(21)18-14-5-4-6-15(11-14)26(23,24)19-9-2-3-10-19/h4-6,11H,2-3,7-10,12H2,1H3,(H,18,21)