ethyl 1-[(2R)-2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2R)-2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(2R)-2-hydroxy-3-(2-thienylmethoxy)propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2R)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2R)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(2R)-2-hydroxy-3-(2-thenyloxy)propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C16H26NO4S+ MolecularWeight: 328.44694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC(COCC2=CC=CS2)O

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)C[C@H](COCC2=CC=CS2)O

InChI

InChI=1S/C16H25NO4S/c1-2-21-16(19)13-5-7-17(8-6-13)10-14(18)11-20-12-15-4-3-9-22-15/h3-4,9,13-14,18H,2,5-8,10-12H2,1H3/p+1/t14-/m1/s1