2-[4-[[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]methyl]-2-methoxy-phenoxy]ethanamide

Systemtic Name: 2-[4-[[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]methyl]-2-methoxy-phenoxy]ethanamide Openeye Name: 2-[4-[[[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]methyl]-2-methoxy-phenoxy]acetamide CAS Name: 2-[4-[[[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]methyl]-2-methoxyphenoxy]acetamide IUPAC Name: 2-[4-[[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]amino]methyl]-2-methoxyphenoxy]acetamide Traditional Name: 2-[4-[[[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]methyl]-2-methoxy-phenoxy]acetamide Formula: C20H28N3O4+ MolecularWeight: 374.45402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC(C2=CC=CO2)[NH+]3CCCC3)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)CNC[C@@H](C2=CC=CO2)[NH+]3CCCC3)OCC(=O)N

InChI

InChI=1S/C20H27N3O4/c1-25-19-11-15(6-7-18(19)27-14-20(21)24)12-22-13-16(17-5-4-10-26-17)23-8-2-3-9-23/h4-7,10-11,16,22H,2-3,8-9,12-14H2,1H3,(H2,21,24)/p+1/t16-/m0/s1