ethyl 2-[2-methyl-4-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-methyl-4-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoyl]phenoxy]ethanoate Openeye Name: ethyl 2-[2-methyl-4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxy]acetate CAS Name: 2-[2-methyl-4-[1-oxo-2-(4-pyridin-4-yl-1-piperazinyl)ethyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-methyl-4-[2-(4-pyridin-4-ylpiperazin-1-yl)acetyl]phenoxy]acetate Traditional Name: 2-[2-methyl-4-[2-[4-(4-pyridyl)piperazino]acetyl]phenoxy]acetic acid ethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-3-28-22(27)16-29-21-5-4-18(14-17(21)2)20(26)15-24-10-12-25(13-11-24)19-6-8-23-9-7-19/h4-9,14H,3,10-13,15-16H2,1-2H3