2-[(5-pyridin-4-ylpyridin-2-yl)amino]ethyl pyridine-3-carboxylate

Systemtic Name: 2-[(5-pyridin-4-ylpyridin-2-yl)amino]ethyl pyridine-3-carboxylate Openeye Name: 2-[[5-(4-pyridyl)-2-pyridyl]amino]ethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 2-[(5-pyridin-4-yl-2-pyridinyl)amino]ethyl ester IUPAC Name: 2-[(5-pyridin-4-ylpyridin-2-yl)amino]ethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 2-[[5-(4-pyridyl)-2-pyridyl]amino]ethyl ester Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCCNC2=NC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCCNC2=NC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C18H16N4O2/c23-18(16-2-1-7-20-12-16)24-11-10-21-17-4-3-15(13-22-17)14-5-8-19-9-6-14/h1-9,12-13H,10-11H2,(H,21,22)