5-chloranyl-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]thiophene-2-carboxamide Formula: C16H20ClN2O2S+ MolecularWeight: 339.8602

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=CC=C(S2)Cl)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC=C(S2)Cl)C3=CC=CO3

InChI

InChI=1S/C16H19ClN2O2S/c17-15-7-6-14(22-15)16(20)18-11-12(13-5-4-10-21-13)19-8-2-1-3-9-19/h4-7,10,12H,1-3,8-9,11H2,(H,18,20)/p+1/t12-/m0/s1