2-[1-ethyl-4-(oxan-2-yl)-2-oxidanylidene-pyrrolidin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[1-ethyl-4-(oxan-2-yl)-2-oxidanylidene-pyrrolidin-1-ium-1-yl]ethanoate Openeye Name: 2-(1-ethyl-2-oxo-4-tetrahydropyran-2-yl-pyrrolidin-1-ium-1-yl)acetate CAS Name: 2-[1-ethyl-4-(2-oxanyl)-2-oxo-1-pyrrolidin-1-iumyl]acetate IUPAC Name: 2-[1-ethyl-4-(oxan-2-yl)-2-oxopyrrolidin-1-ium-1-yl]acetate Traditional Name: 2-(1-ethyl-2-keto-4-tetrahydropyran-2-yl-pyrrolidin-1-ium-1-yl)acetate Formula: C13H21NO4 MolecularWeight: 255.31014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CC(CC1=O)C2CCCCO2)CC(=O)[O-]

Isomeric SMILES

CC[N+]1(CC(CC1=O)C2CCCCO2)CC(=O)[O-]

InChI

InChI=1S/C13H21NO4/c1-2-14(9-13(16)17)8-10(7-12(14)15)11-5-3-4-6-18-11/h10-11H,2-9H2,1H3