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

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl] 3-acetamidopropanoate Openeye Name: [2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] 3-acetamidopropanoate CAS Name: 3-acetamidopropanoic acid [2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl] 3-acetamidopropanoate Traditional Name: 3-acetamidopropionic acid [2-keto-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O6S/c1-14(22)19-10-9-18(24)27-13-17(23)20-15-5-7-16(8-6-15)28(25,26)21-11-3-2-4-12-21/h5-8H,2-4,9-13H2,1H3,(H,19,22)(H,20,23)