ethyl 4-[pyridin-3-ylcarbonyl(pyridin-4-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[pyridin-3-ylcarbonyl(pyridin-4-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[pyridine-3-carbonyl(4-pyridylmethyl)amino]benzoate CAS Name: 4-[[oxo(3-pyridinyl)methyl]-(pyridin-4-ylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[pyridine-3-carbonyl(pyridin-4-ylmethyl)amino]benzoate Traditional Name: 4-[nicotinoyl(4-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CC2=CC=NC=C2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=CC=NC=C2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H19N3O3/c1-2-27-21(26)17-5-7-19(8-6-17)24(15-16-9-12-22-13-10-16)20(25)18-4-3-11-23-14-18/h3-14H,2,15H2,1H3