2-(piperidin-1-ium-1-ylmethyl)-1,3-thiazole-4-carboxylate

Systemtic Name: 2-(piperidin-1-ium-1-ylmethyl)-1,3-thiazole-4-carboxylate Openeye Name: 2-(piperidin-1-ium-1-ylmethyl)thiazole-4-carboxylate CAS Name: 2-(1-piperidin-1-iumylmethyl)-4-thiazolecarboxylate IUPAC Name: 2-(piperidin-1-ium-1-ylmethyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(piperidin-1-ium-1-ylmethyl)thiazole-4-carboxylate Formula: C10H14N2O2S MolecularWeight: 226.29536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=NC(=CS2)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CC2=NC(=CS2)C(=O)[O-]

InChI

InChI=1S/C10H14N2O2S/c13-10(14)8-7-15-9(11-8)6-12-4-2-1-3-5-12/h7H,1-6H2,(H,13,14)