ethyl 1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-(2-thienylmethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-(thiophen-2-ylmethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-(2-thenyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C13H20NO2S+ MolecularWeight: 254.3684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CC=CS2

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CC=CS2

InChI

InChI=1S/C13H19NO2S/c1-2-16-13(15)11-5-7-14(8-6-11)10-12-4-3-9-17-12/h3-4,9,11H,2,5-8,10H2,1H3/p+1