5-ethyl-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-thiophene-2-carboxamide

Systemtic Name: 5-ethyl-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-thiophene-2-carboxamide Openeye Name: 5-ethyl-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-thiophene-2-carboxamide CAS Name: 5-ethyl-N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-4-methyl-2-thiophenecarboxamide IUPAC Name: 5-ethyl-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-4-methylthiophene-2-carboxamide Traditional Name: 5-ethyl-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-thiophene-2-carboxamide Formula: C19H27N2O2S+ MolecularWeight: 347.49488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCCC3)C

InChI

InChI=1S/C19H26N2O2S/c1-3-17-14(2)12-18(24-17)19(22)20-13-15(16-8-7-11-23-16)21-9-5-4-6-10-21/h7-8,11-12,15H,3-6,9-10,13H2,1-2H3,(H,20,22)/p+1/t15-/m0/s1