[4-[2-(ethylamino)ethyl]-2-pyridin-3-ylcarbonyloxy-phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[2-(ethylamino)ethyl]-2-pyridin-3-ylcarbonyloxy-phenyl] pyridine-3-carboxylate Openeye Name: [4-[2-(ethylamino)ethyl]-2-(pyridine-3-carbonyloxy)phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[2-(ethylamino)ethyl]-2-[oxo(3-pyridinyl)methoxy]phenyl] ester IUPAC Name: [4-[2-(ethylamino)ethyl]-2-(pyridine-3-carbonyloxy)phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[2-(ethylamino)ethyl]-2-nicotinoyloxy-phenyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCNCCC1=CC(=C(C=C1)OC(=O)C2=CN=CC=C2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

CCNCCC1=CC(=C(C=C1)OC(=O)C2=CN=CC=C2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H21N3O4/c1-2-23-12-9-16-7-8-19(28-21(26)17-5-3-10-24-14-17)20(13-16)29-22(27)18-6-4-11-25-15-18/h3-8,10-11,13-15,23H,2,9,12H2,1H3