(3S)-4-oxidanylidene-4-propan-2-yloxy-3-pyrrolidin-1-ium-1-yl-butanoate

Systemtic Name: (3S)-4-oxidanylidene-4-propan-2-yloxy-3-pyrrolidin-1-ium-1-yl-butanoate Openeye Name: (3S)-4-isopropoxy-4-oxo-3-pyrrolidin-1-ium-1-yl-butanoate CAS Name: (3S)-4-oxo-4-propan-2-yloxy-3-(1-pyrrolidin-1-iumyl)butanoate IUPAC Name: (3S)-4-oxo-4-propan-2-yloxy-3-pyrrolidin-1-ium-1-ylbutanoate Traditional Name: (3S)-4-isopropoxy-4-keto-3-pyrrolidin-1-ium-1-yl-butyrate Formula: C11H19NO4 MolecularWeight: 229.27286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC(=O)[O-])[NH+]1CCCC1

Isomeric SMILES

CC(C)OC(=O)[C@H](CC(=O)[O-])[NH+]1CCCC1

InChI

InChI=1S/C11H19NO4/c1-8(2)16-11(15)9(7-10(13)14)12-5-3-4-6-12/h8-9H,3-7H2,1-2H3,(H,13,14)/t9-/m0/s1