1-prop-2-ynylpiperidin-1-ium-4-carboxylate

Systemtic Name: 1-prop-2-ynylpiperidin-1-ium-4-carboxylate Openeye Name: 1-prop-2-ynylpiperidin-1-ium-4-carboxylate CAS Name: 1-prop-2-ynyl-4-piperidin-1-iumcarboxylate IUPAC Name: 1-prop-2-ynylpiperidin-1-ium-4-carboxylate Traditional Name: 1-propargylpiperidin-1-ium-4-carboxylate Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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