4-(pyridin-4-ylmethylazaniumyl)butanoate

Systemtic Name: 4-(pyridin-4-ylmethylazaniumyl)butanoate Openeye Name: 4-(4-pyridylmethylammonio)butanoate CAS Name: 4-(pyridin-4-ylmethylammonio)butanoate IUPAC Name: 4-(pyridin-4-ylmethylazaniumyl)butanoate Traditional Name: 4-(4-pyridylmethylammonio)butyrate Formula: C10H14N2O2 MolecularWeight: 194.23036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O2/c13-10(14)2-1-5-12-8-9-3-6-11-7-4-9/h3-4,6-7,12H,1-2,5,8H2,(H,13,14)