1-[2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[[(3S)-1,1-dioxo-3-thiolanyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[[(3S)-1,1-diketothiolan-3-yl]amino]-2-keto-ethyl]piperidin-1-ium-4-carboxylate Formula: C12H20N2O5S MolecularWeight: 304.3626

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)[O-])CC(=O)NC2CCS(=O)(=O)C2

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC(=O)C[NH+]2CCC(CC2)C(=O)[O-]

InChI

InChI=1S/C12H20N2O5S/c15-11(13-10-3-6-20(18,19)8-10)7-14-4-1-9(2-5-14)12(16)17/h9-10H,1-8H2,(H,13,15)(H,16,17)/t10-/m0/s1