(3S)-1-prop-2-ynylpiperidin-1-ium-3-carboxylate

Systemtic Name: (3S)-1-prop-2-ynylpiperidin-1-ium-3-carboxylate Openeye Name: (3S)-1-prop-2-ynylpiperidin-1-ium-3-carboxylate CAS Name: (3S)-1-prop-2-ynyl-3-piperidin-1-iumcarboxylate IUPAC Name: (3S)-1-prop-2-ynylpiperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-propargylpiperidin-1-ium-3-carboxylate Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH+]1CCCC(C1)C(=O)[O-]

Isomeric SMILES

C#CC[NH+]1CCC[C@@H](C1)C(=O)[O-]

InChI

InChI=1S/C9H13NO2/c1-2-5-10-6-3-4-8(7-10)9(11)12/h1,8H,3-7H2,(H,11,12)/t8-/m0/s1