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

Systemtic Name: (2R)-1-[[5-(phenylcarbonyl)thiophen-2-yl]methyl]piperidin-1-ium-2-carboxylate Openeye Name: (2R)-1-[(5-benzoyl-2-thienyl)methyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[(5-benzoyl-2-thiophenyl)methyl]-2-piperidin-1-iumcarboxylate IUPAC Name: (2R)-1-[(5-benzoylthiophen-2-yl)methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-[(5-benzoyl-2-thienyl)methyl]piperidin-1-ium-2-carboxylate Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)[O-])CC2=CC=C(S2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)[O-])CC2=CC=C(S2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO3S/c20-17(13-6-2-1-3-7-13)16-10-9-14(23-16)12-19-11-5-4-8-15(19)18(21)22/h1-3,6-7,9-10,15H,4-5,8,11-12H2,(H,21,22)/t15-/m1/s1