3-(pyridin-4-ylmethylamino)benzoate

Systemtic Name: 3-(pyridin-4-ylmethylamino)benzoate Openeye Name: 3-(4-pyridylmethylamino)benzoate CAS Name: 3-(pyridin-4-ylmethylamino)benzoate IUPAC Name: 3-(pyridin-4-ylmethylamino)benzoate Traditional Name: 3-(4-pyridylmethylamino)benzoate Formula: C13H11N2O2- MolecularWeight: 227.23864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=CC=NC=C2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=CC=NC=C2)C(=O)[O-]

InChI

InChI=1S/C13H12N2O2/c16-13(17)11-2-1-3-12(8-11)15-9-10-4-6-14-7-5-10/h1-8,15H,9H2,(H,16,17)/p-1