methyl 2-[4-[2-(2-oxidanylidene-4-pyridin-4-yl-piperazin-1-yl)ethanoyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[2-(2-oxidanylidene-4-pyridin-4-yl-piperazin-1-yl)ethanoyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[2-[2-oxo-4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxy]acetate CAS Name: 2-[4-[1-oxo-2-(2-oxo-4-pyridin-4-yl-1-piperazinyl)ethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-(2-oxo-4-pyridin-4-ylpiperazin-1-yl)acetyl]phenoxy]acetate Traditional Name: 2-[4-[2-[2-keto-4-(4-pyridyl)piperazino]acetyl]phenoxy]acetic acid methyl ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C(=O)CN2CCN(CC2=O)C3=CC=NC=C3

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C(=O)CN2CCN(CC2=O)C3=CC=NC=C3

InChI

InChI=1S/C20H21N3O5/c1-27-20(26)14-28-17-4-2-15(3-5-17)18(24)12-23-11-10-22(13-19(23)25)16-6-8-21-9-7-16/h2-9H,10-14H2,1H3