4-[(2S)-2-ethylpiperidin-1-ium-1-yl]butanoate

Systemtic Name: 4-[(2S)-2-ethylpiperidin-1-ium-1-yl]butanoate Openeye Name: 4-[(2S)-2-ethylpiperidin-1-ium-1-yl]butanoate CAS Name: 4-[(2S)-2-ethyl-1-piperidin-1-iumyl]butanoate IUPAC Name: 4-[(2S)-2-ethylpiperidin-1-ium-1-yl]butanoate Traditional Name: 4-[(2S)-2-ethylpiperidin-1-ium-1-yl]butyrate Formula: C11H21NO2 MolecularWeight: 199.28994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CCCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H21NO2/c1-2-10-6-3-4-8-12(10)9-5-7-11(13)14/h10H,2-9H2,1H3,(H,13,14)/t10-/m0/s1