ethyl 1-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[[2-(2-thienyl)thiazol-4-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2-thiophen-2-yl-4-thiazolyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[2-(2-thienyl)thiazol-4-yl]methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C16H21N2O2S2+ MolecularWeight: 337.48014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CSC(=N2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CSC(=N2)C3=CC=CS3

InChI

InChI=1S/C16H20N2O2S2/c1-2-20-16(19)12-5-7-18(8-6-12)10-13-11-22-15(17-13)14-4-3-9-21-14/h3-4,9,11-12H,2,5-8,10H2,1H3/p+1