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

Systemtic Name: [4-[2-(propan-2-ylamino)ethyl]-2-pyridin-3-ylcarbonyloxy-phenyl] pyridine-3-carboxylate Openeye Name: [4-[2-(isopropylamino)ethyl]-2-(pyridine-3-carbonyloxy)phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[oxo(3-pyridinyl)methoxy]-4-[2-(propan-2-ylamino)ethyl]phenyl] ester IUPAC Name: [4-[2-(propan-2-ylamino)ethyl]-2-(pyridine-3-carbonyloxy)phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[2-(isopropylamino)ethyl]-2-nicotinoyloxy-phenyl] ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCC1=CC(=C(C=C1)OC(=O)C2=CN=CC=C2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)NCCC1=CC(=C(C=C1)OC(=O)C2=CN=CC=C2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C23H23N3O4/c1-16(2)26-12-9-17-7-8-20(29-22(27)18-5-3-10-24-14-18)21(13-17)30-23(28)19-6-4-11-25-15-19/h3-8,10-11,13-16,26H,9,12H2,1-2H3