(2R)-1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-2-carboxylate

Systemtic Name: (2R)-1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-2-carboxylate Openeye Name: (2R)-1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[(5-methyl-2-thiophenyl)methyl]-2-piperidin-1-iumcarboxylate IUPAC Name: (2R)-1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-2-carboxylate Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+]2CCCCC2C(=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)C[NH+]2CCCC[C@@H]2C(=O)[O-]

InChI

InChI=1S/C12H17NO2S/c1-9-5-6-10(16-9)8-13-7-3-2-4-11(13)12(14)15/h5-6,11H,2-4,7-8H2,1H3,(H,14,15)/t11-/m1/s1