N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)furan-2-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)furan-2-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)furan-2-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-3-(phenoxymethyl)-2-furancarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-3-(phenoxymethyl)furan-2-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)-2-furamide Formula: C23H27N2O4+ MolecularWeight: 395.47148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=C(C=CO2)COC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=C(C=CO2)COC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C23H26N2O4/c26-23(22-18(11-15-28-22)17-29-19-8-3-1-4-9-19)24-16-20(21-10-7-14-27-21)25-12-5-2-6-13-25/h1,3-4,7-11,14-15,20H,2,5-6,12-13,16-17H2,(H,24,26)/p+1/t20-/m0/s1