4-oxidanylidene-2-[(phenylmethyl)sulfonylmethyl]-4-piperidin-1-yl-butanoic acid

Systemtic Name: 4-oxidanylidene-2-[(phenylmethyl)sulfonylmethyl]-4-piperidin-1-yl-butanoic acid Openeye Name: 2-(benzylsulfonylmethyl)-4-oxo-4-(1-piperidyl)butanoic acid CAS Name: 4-oxo-2-[(phenylmethyl)sulfonylmethyl]-4-(1-piperidinyl)butanoic acid IUPAC Name: 2-(benzylsulfonylmethyl)-4-oxo-4-piperidin-1-ylbutanoic acid Traditional Name: 2-(benzylsulfonylmethyl)-4-keto-4-piperidino-butyric acid Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CC(CS(=O)(=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)CC(CS(=O)(=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H23NO5S/c19-16(18-9-5-2-6-10-18)11-15(17(20)21)13-24(22,23)12-14-7-3-1-4-8-14/h1,3-4,7-8,15H,2,5-6,9-13H2,(H,20,21)