(2S)-3-methyl-2-(4-oxidanylpiperidin-1-ium-1-yl)butanoate

Systemtic Name: (2S)-3-methyl-2-(4-oxidanylpiperidin-1-ium-1-yl)butanoate Openeye Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-3-methyl-butanoate CAS Name: (2S)-2-(4-hydroxy-1-piperidin-1-iumyl)-3-methylbutanoate IUPAC Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-3-methylbutanoate Traditional Name: (2S)-2-(4-hydroxypiperidin-1-ium-1-yl)-3-methyl-butyrate Formula: C10H19NO3 MolecularWeight: 201.26276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])[NH+]1CCC(CC1)O

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])[NH+]1CCC(CC1)O

InChI

InChI=1S/C10H19NO3/c1-7(2)9(10(13)14)11-5-3-8(12)4-6-11/h7-9,12H,3-6H2,1-2H3,(H,13,14)/t9-/m0/s1