2-phenoxy-2-(4-pyridin-4-ylpiperazin-1-yl)pentanoic acid

Systemtic Name: 2-phenoxy-2-(4-pyridin-4-ylpiperazin-1-yl)pentanoic acid Openeye Name: 2-phenoxy-2-[4-(4-pyridyl)piperazin-1-yl]pentanoic acid CAS Name: 2-phenoxy-2-(4-pyridin-4-yl-1-piperazinyl)pentanoic acid IUPAC Name: 2-phenoxy-2-(4-pyridin-4-ylpiperazin-1-yl)pentanoic acid Traditional Name: 2-phenoxy-2-[4-(4-pyridyl)piperazino]valeric acid Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)(N1CCN(CC1)C2=CC=NC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCC(C(=O)O)(N1CCN(CC1)C2=CC=NC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3/c1-2-10-20(19(24)25,26-18-6-4-3-5-7-18)23-15-13-22(14-16-23)17-8-11-21-12-9-17/h3-9,11-12H,2,10,13-16H2,1H3,(H,24,25)