2,2-dimethylpropyl 2-[4-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoyl]phenoxy]ethanoate

Systemtic Name: 2,2-dimethylpropyl 2-[4-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoyl]phenoxy]ethanoate Openeye Name: 2,2-dimethylpropyl 2-[4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxy]acetate CAS Name: 2-[4-[1-oxo-2-(4-pyridin-4-yl-1-piperazinyl)ethyl]phenoxy]acetic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 2-[4-[2-(4-pyridin-4-ylpiperazin-1-yl)acetyl]phenoxy]acetate Traditional Name: 2-[4-[2-[4-(4-pyridyl)piperazino]acetyl]phenoxy]acetic acid neopentyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O4/c1-24(2,3)18-31-23(29)17-30-21-6-4-19(5-7-21)22(28)16-26-12-14-27(15-13-26)20-8-10-25-11-9-20/h4-11H,12-18H2,1-3H3