4-[(pyridin-2-ylmethylazaniumyl)methyl]benzoate

Systemtic Name: 4-[(pyridin-2-ylmethylazaniumyl)methyl]benzoate Openeye Name: 4-[(2-pyridylmethylammonio)methyl]benzoate CAS Name: 4-[(2-pyridinylmethylammonio)methyl]benzoate IUPAC Name: 4-[(pyridin-2-ylmethylazaniumyl)methyl]benzoate Traditional Name: 4-[(2-pyridylmethylammonio)methyl]benzoate Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C[NH2+]CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)C[NH2+]CC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C14H14N2O2/c17-14(18)12-6-4-11(5-7-12)9-15-10-13-3-1-2-8-16-13/h1-8,15H,9-10H2,(H,17,18)