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

Systemtic Name: [2-methyl-4-[3-(4-pyridin-4-ylpiperazin-1-yl)propanoyl]phenyl] ethanoate Openeye Name: [2-methyl-4-[3-[4-(4-pyridyl)piperazin-1-yl]propanoyl]phenyl] acetate CAS Name: acetic acid [2-methyl-4-[1-oxo-3-(4-pyridin-4-yl-1-piperazinyl)propyl]phenyl] ester IUPAC Name: [2-methyl-4-[3-(4-pyridin-4-ylpiperazin-1-yl)propanoyl]phenyl] acetate Traditional Name: acetic acid [2-methyl-4-[3-[4-(4-pyridyl)piperazino]propanoyl]phenyl] ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CCN2CCN(CC2)C3=CC=NC=C3)OC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CCN2CCN(CC2)C3=CC=NC=C3)OC(=O)C

InChI

InChI=1S/C21H25N3O3/c1-16-15-18(3-4-21(16)27-17(2)25)20(26)7-10-23-11-13-24(14-12-23)19-5-8-22-9-6-19/h3-6,8-9,15H,7,10-14H2,1-2H3