(3S)-3-morpholin-4-ium-4-yl-4-oxidanylidene-4-pentoxy-butanoate

Systemtic Name: (3S)-3-morpholin-4-ium-4-yl-4-oxidanylidene-4-pentoxy-butanoate Openeye Name: (3S)-3-morpholin-4-ium-4-yl-4-oxo-4-pentoxy-butanoate CAS Name: (3S)-3-(4-morpholin-4-iumyl)-4-oxo-4-pentoxybutanoate IUPAC Name: (3S)-3-morpholin-4-ium-4-yl-4-oxo-4-pentoxybutanoate Traditional Name: (3S)-4-amoxy-4-keto-3-morpholin-4-ium-4-yl-butyrate Formula: C13H23NO5 MolecularWeight: 273.32542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CC(=O)[O-])[NH+]1CCOCC1

Isomeric SMILES

CCCCCOC(=O)[C@H](CC(=O)[O-])[NH+]1CCOCC1

InChI

InChI=1S/C13H23NO5/c1-2-3-4-7-19-13(17)11(10-12(15)16)14-5-8-18-9-6-14/h11H,2-10H2,1H3,(H,15,16)/t11-/m0/s1