1-[2-[butyl(methyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: 1-[2-[butyl(methyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[2-[butyl(methyl)amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[butyl(methyl)amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[2-[butyl(methyl)amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[butyl(methyl)amino]-2-keto-ethyl]piperidin-1-ium-4-carboxylate Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H24N2O3/c1-3-4-7-14(2)12(16)10-15-8-5-11(6-9-15)13(17)18/h11H,3-10H2,1-2H3,(H,17,18)