(3S)-4-ethoxy-4-oxidanylidene-3-piperidin-1-ium-1-yl-butanoate

Systemtic Name: (3S)-4-ethoxy-4-oxidanylidene-3-piperidin-1-ium-1-yl-butanoate Openeye Name: (3S)-4-ethoxy-4-oxo-3-piperidin-1-ium-1-yl-butanoate CAS Name: (3S)-4-ethoxy-4-oxo-3-(1-piperidin-1-iumyl)butanoate IUPAC Name: (3S)-4-ethoxy-4-oxo-3-piperidin-1-ium-1-ylbutanoate Traditional Name: (3S)-4-ethoxy-4-keto-3-piperidin-1-ium-1-yl-butyrate Formula: C11H19NO4 MolecularWeight: 229.27286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)[O-])[NH+]1CCCCC1

Isomeric SMILES

CCOC(=O)[C@H](CC(=O)[O-])[NH+]1CCCCC1

InChI

InChI=1S/C11H19NO4/c1-2-16-11(15)9(8-10(13)14)12-6-4-3-5-7-12/h9H,2-8H2,1H3,(H,13,14)/t9-/m0/s1