methyl 2-[3-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]ethanoate

Systemtic Name: methyl 2-[3-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]ethanoate Openeye Name: methyl 2-[3-[4-(4-pyridyl)piperazin-1-yl]phenoxy]acetate CAS Name: 2-[3-(4-pyridin-4-yl-1-piperazinyl)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]acetate Traditional Name: 2-[3-[4-(4-pyridyl)piperazino]phenoxy]acetic acid methyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC(=C1)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)COC1=CC=CC(=C1)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C18H21N3O3/c1-23-18(22)14-24-17-4-2-3-16(13-17)21-11-9-20(10-12-21)15-5-7-19-8-6-15/h2-8,13H,9-12,14H2,1H3