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

Systemtic Name: ethyl 4-[2-propyl-4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate Openeye Name: ethyl 4-[2-propyl-4-[4-(4-pyridyl)piperazin-1-yl]phenoxy]butanoate CAS Name: 4-[2-propyl-4-(4-pyridin-4-yl-1-piperazinyl)phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-propyl-4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoate Traditional Name: 4-[2-propyl-4-[4-(4-pyridyl)piperazino]phenoxy]butyric acid ethyl ester Formula: C24H33N3O3 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)N2CCN(CC2)C3=CC=NC=C3)OCCCC(=O)OCC

Isomeric SMILES

CCCC1=C(C=CC(=C1)N2CCN(CC2)C3=CC=NC=C3)OCCCC(=O)OCC

InChI

InChI=1S/C24H33N3O3/c1-3-6-20-19-22(8-9-23(20)30-18-5-7-24(28)29-4-2)27-16-14-26(15-17-27)21-10-12-25-13-11-21/h8-13,19H,3-7,14-18H2,1-2H3