[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] 2-(3-chloranylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] 2-(3-chloranylphenoxy)propanoate Openeye Name: [2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl] 2-(3-chlorophenoxy)propanoate CAS Name: 2-(3-chlorophenoxy)propanoic acid [2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] 2-(3-chlorophenoxy)propanoate Traditional Name: 2-(3-chlorophenoxy)propionic acid [2-keto-2-[4-(2-pyridyl)piperazino]ethyl] ester Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N1CCN(CC1)C2=CC=CC=N2)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)OCC(=O)N1CCN(CC1)C2=CC=CC=N2)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3O4/c1-15(28-17-6-4-5-16(21)13-17)20(26)27-14-19(25)24-11-9-23(10-12-24)18-7-2-3-8-22-18/h2-8,13,15H,9-12,14H2,1H3