1-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[(1,1-dioxothiolan-3-yl)-methyl-amino]-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[(1,1-diketothiolan-3-yl)-methyl-amino]-2-keto-ethyl]isonipecotic acid Formula: C13H22N2O5S MolecularWeight: 318.38918

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)CN2CCC(CC2)C(=O)O

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C13H22N2O5S/c1-14(11-4-7-21(19,20)9-11)12(16)8-15-5-2-10(3-6-15)13(17)18/h10-11H,2-9H2,1H3,(H,17,18)