6-(pyridin-1-ium-3-ylcarbonylamino)hexanoic acid

Systemtic Name: 6-(pyridin-1-ium-3-ylcarbonylamino)hexanoic acid Openeye Name: 6-(pyridin-1-ium-3-carbonylamino)hexanoic acid CAS Name: 6-[[oxo(3-pyridin-1-iumyl)methyl]amino]hexanoic acid IUPAC Name: 6-(pyridin-1-ium-3-carbonylamino)hexanoic acid Traditional Name: 6-(pyridin-1-ium-3-carbonylamino)hexanoic acid Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c15-11(16)6-2-1-3-8-14-12(17)10-5-4-7-13-9-10/h4-5,7,9H,1-3,6,8H2,(H,14,17)(H,15,16)/p+1