ethyl (3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-[(3-methyl-2-thienyl)methyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[(3-methyl-2-thiophenyl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-[(3-methyl-2-thienyl)methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C14H22NO2S+ MolecularWeight: 268.39498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC2=C(C=CS2)C

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CC2=C(C=CS2)C

InChI

InChI=1S/C14H21NO2S/c1-3-17-14(16)12-5-4-7-15(9-12)10-13-11(2)6-8-18-13/h6,8,12H,3-5,7,9-10H2,1-2H3/p+1/t12-/m1/s1