2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide

Systemtic Name: 2-[3-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide Openeye Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide CAS Name: N-(3-hydroxy-2-pyridin-1-iumyl)-2-[3-(2-oxo-1-pyrrolidinyl)phenoxy]acetamide IUPAC Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide Traditional Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-[3-(2-ketopyrrolidino)phenoxy]acetamide Formula: C17H18N3O4+ MolecularWeight: 328.34252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)OCC(=O)NC3=C(C=CC=[NH+]3)O

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)OCC(=O)NC3=C(C=CC=[NH+]3)O

InChI

InChI=1S/C17H17N3O4/c21-14-6-2-8-18-17(14)19-15(22)11-24-13-5-1-4-12(10-13)20-9-3-7-16(20)23/h1-2,4-6,8,10,21H,3,7,9,11H2,(H,18,19,22)/p+1