3-(pyridin-3-ylmethylazaniumyl)propanoate

Systemtic Name: 3-(pyridin-3-ylmethylazaniumyl)propanoate Openeye Name: 3-(3-pyridylmethylammonio)propanoate CAS Name: 3-(3-pyridinylmethylammonio)propanoate IUPAC Name: 3-(pyridin-3-ylmethylazaniumyl)propanoate Traditional Name: 3-(3-pyridylmethylammonio)propionate Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C[NH2+]CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C[NH2+]CCC(=O)[O-]

InChI

InChI=1S/C9H12N2O2/c12-9(13)3-5-11-7-8-2-1-4-10-6-8/h1-2,4,6,11H,3,5,7H2,(H,12,13)