2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: 2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: 2-pyridin-1-ium-3-ylthiazolidin-3-ium-4-carboxylate CAS Name: 2-(3-pyridin-1-iumyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: 2-pyridin-1-ium-3-yl-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: 2-pyridin-1-ium-3-ylthiazolidin-3-ium-4-carboxylate Formula: C9H11N2O2S+ MolecularWeight: 211.26084

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH2+]C(S1)C2=C[NH+]=CC=C2)C(=O)[O-]

Isomeric SMILES

C1C([NH2+]C(S1)C2=C[NH+]=CC=C2)C(=O)[O-]

InChI

InChI=1S/C9H10N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7-8,11H,5H2,(H,12,13)/p+1