ethyl 4-[2-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate

Systemtic Name: ethyl 4-[2-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate Openeye Name: ethyl 4-[2-[4-(4-pyridyl)piperazin-1-yl]phenoxy]butanoate CAS Name: 4-[2-(4-pyridin-4-yl-1-piperazinyl)phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate Traditional Name: 4-[2-[4-(4-pyridyl)piperazino]phenoxy]butyric acid ethyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC=CC=C1N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)CCCOC1=CC=CC=C1N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C21H27N3O3/c1-2-26-21(25)8-5-17-27-20-7-4-3-6-19(20)24-15-13-23(14-16-24)18-9-11-22-12-10-18/h3-4,6-7,9-12H,2,5,8,13-17H2,1H3