6-(pyridin-1-ium-4-ylamino)hexanoate

Systemtic Name: 6-(pyridin-1-ium-4-ylamino)hexanoate Openeye Name: 6-(pyridin-1-ium-4-ylamino)hexanoate CAS Name: 6-(4-pyridin-1-iumylamino)hexanoate IUPAC Name: 6-(pyridin-1-ium-4-ylamino)hexanoate Traditional Name: 6-(pyridin-1-ium-4-ylamino)hexanoate Formula: C11H16N2O2 MolecularWeight: 208.25694

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[NH+]=CC=C1NCCCCCC(=O)[O-]

Isomeric SMILES

C1=C[NH+]=CC=C1NCCCCCC(=O)[O-]

InChI

InChI=1S/C11H16N2O2/c14-11(15)4-2-1-3-7-13-10-5-8-12-9-6-10/h5-6,8-9H,1-4,7H2,(H,12,13)(H,14,15)