6-(pyridin-1-ium-2-ylamino)hexanoate

Systemtic Name: 6-(pyridin-1-ium-2-ylamino)hexanoate Openeye Name: 6-(pyridin-1-ium-2-ylamino)hexanoate CAS Name: 6-(2-pyridin-1-iumylamino)hexanoate IUPAC Name: 6-(pyridin-1-ium-2-ylamino)hexanoate Traditional Name: 6-(pyridin-1-ium-2-ylamino)hexanoate Formula: C11H16N2O2 MolecularWeight: 208.25694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O2/c14-11(15)7-2-1-4-8-12-10-6-3-5-9-13-10/h3,5-6,9H,1-2,4,7-8H2,(H,12,13)(H,14,15)