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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)OCC(=O)OC)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)OCC(=O)OC)N2CCN(CC2)C3=CC=NC=C3

InChI

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