6-(pyridin-4-ylmethylazaniumyl)hexanoate

Systemtic Name: 6-(pyridin-4-ylmethylazaniumyl)hexanoate Openeye Name: 6-(4-pyridylmethylammonio)hexanoate CAS Name: 6-(pyridin-4-ylmethylammonio)hexanoate IUPAC Name: 6-(pyridin-4-ylmethylazaniumyl)hexanoate Traditional Name: 6-(4-pyridylmethylammonio)hexanoate Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C[NH2+]CCCCCC(=O)[O-]

Isomeric SMILES

C1=CN=CC=C1C[NH2+]CCCCCC(=O)[O-]

InChI

InChI=1S/C12H18N2O2/c15-12(16)4-2-1-3-7-14-10-11-5-8-13-9-6-11/h5-6,8-9,14H,1-4,7,10H2,(H,15,16)