2-chloranyl-4-(pyridin-4-ylmethylamino)benzoate

Systemtic Name: 2-chloranyl-4-(pyridin-4-ylmethylamino)benzoate Openeye Name: 2-chloro-4-(4-pyridylmethylamino)benzoate CAS Name: 2-chloro-4-(pyridin-4-ylmethylamino)benzoate IUPAC Name: 2-chloro-4-(pyridin-4-ylmethylamino)benzoate Traditional Name: 2-chloro-4-(4-pyridylmethylamino)benzoate Formula: C13H10ClN2O2- MolecularWeight: 261.6837

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC2=CC=NC=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1NCC2=CC=NC=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C13H11ClN2O2/c14-12-7-10(1-2-11(12)13(17)18)16-8-9-3-5-15-6-4-9/h1-7,16H,8H2,(H,17,18)/p-1