2-[3-(2-hydroxyethyl)-2-oxidanylidene-1-phenethyl-1-phenylmethoxy-pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-[3-(2-hydroxyethyl)-2-oxidanylidene-1-phenethyl-1-phenylmethoxy-pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: 2-[1-benzyloxy-3-(2-hydroxyethyl)-2-oxo-1-phenethyl-pyrrolidin-1-ium-3-yl]acetamide CAS Name: 2-[3-(2-hydroxyethyl)-2-oxo-1-phenethyl-1-phenylmethoxy-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[3-(2-hydroxyethyl)-2-oxo-1-phenethyl-1-phenylmethoxypyrrolidin-1-ium-3-yl]acetamide Traditional Name: 2-[1-benzoxy-3-(2-hydroxyethyl)-2-keto-1-phenethyl-pyrrolidin-1-ium-3-yl]acetamide Formula: C23H29N2O4+ MolecularWeight: 397.48736

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](C(=O)C1(CCO)CC(=O)N)(CCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1C[N+](C(=O)C1(CCO)CC(=O)N)(CCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4/c24-21(27)17-23(13-16-26)12-15-25(22(23)28,14-11-19-7-3-1-4-8-19)29-18-20-9-5-2-6-10-20/h1-10,26H,11-18H2,(H-,24,27)/p+1