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

Systemtic Name: N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)furan-2-carboxamide Openeye Name: N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)furan-2-carboxamide CAS Name: N-[(2S)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-(phenoxymethyl)-2-furancarboxamide IUPAC Name: N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-(phenoxymethyl)furan-2-carboxamide Traditional Name: N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(phenoxymethyl)-2-furamide Formula: C25H29N2O4+ MolecularWeight: 421.50876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)C2=C(C=CO2)COC3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1[C@@H](CNC(=O)C2=C(C=CO2)COC3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C25H28N2O4/c1-29-23-12-6-5-11-21(23)22(27-14-7-8-15-27)17-26-25(28)24-19(13-16-30-24)18-31-20-9-3-2-4-10-20/h2-6,9-13,16,22H,7-8,14-15,17-18H2,1H3,(H,26,28)/p+1/t22-/m1/s1