6-(3-pyridin-1-ium-1-ylpropanoylamino)hexanoate

Systemtic Name: 6-(3-pyridin-1-ium-1-ylpropanoylamino)hexanoate Openeye Name: 6-(3-pyridin-1-ium-1-ylpropanoylamino)hexanoate CAS Name: 6-[[1-oxo-3-(1-pyridin-1-iumyl)propyl]amino]hexanoate IUPAC Name: 6-(3-pyridin-1-ium-1-ylpropanoylamino)hexanoate Traditional Name: 6-(3-pyridin-1-ium-1-ylpropanoylamino)hexanoate Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCC(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=[N+](C=C1)CCC(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C14H20N2O3/c17-13(8-12-16-10-5-2-6-11-16)15-9-4-1-3-7-14(18)19/h2,5-6,10-11H,1,3-4,7-9,12H2,(H-,15,17,18,19)