2-[2-[2-[4-(2,6-dimethylpyridin-4-yl)piperazin-1-yl]ethanoyl]phenoxy]ethanoate

Systemtic Name: 2-[2-[2-[4-(2,6-dimethylpyridin-4-yl)piperazin-1-yl]ethanoyl]phenoxy]ethanoate Openeye Name: 2-[2-[2-[4-(2,6-dimethyl-4-pyridyl)piperazin-1-yl]acetyl]phenoxy]acetate CAS Name: 2-[2-[2-[4-(2,6-dimethyl-4-pyridinyl)-1-piperazinyl]-1-oxoethyl]phenoxy]acetate IUPAC Name: 2-[2-[2-[4-(2,6-dimethylpyridin-4-yl)piperazin-1-yl]acetyl]phenoxy]acetate Traditional Name: 2-[2-[2-[4-(2,6-dimethyl-4-pyridyl)piperazino]acetyl]phenoxy]acetate Formula: C21H24N3O4- MolecularWeight: 382.43296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)N2CCN(CC2)CC(=O)C3=CC=CC=C3OCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=N1)C)N2CCN(CC2)CC(=O)C3=CC=CC=C3OCC(=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-15-11-17(12-16(2)22-15)24-9-7-23(8-10-24)13-19(25)18-5-3-4-6-20(18)28-14-21(26)27/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,26,27)/p-1