2-[3-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]piperidin-1-yl]ethanoic acid Openeye Name: 2-[3-[4-[4-(4-pyridyl)piperazin-1-yl]phenoxy]-1-piperidyl]acetic acid CAS Name: 2-[3-[4-(4-pyridin-4-yl-1-piperazinyl)phenoxy]-1-piperidinyl]acetic acid IUPAC Name: 2-[3-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]piperidin-1-yl]acetic acid Traditional Name: 2-[3-[4-[4-(4-pyridyl)piperazino]phenoxy]piperidino]acetic acid Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)O)OC2=CC=C(C=C2)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

C1CC(CN(C1)CC(=O)O)OC2=CC=C(C=C2)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C22H28N4O3/c27-22(28)17-24-11-1-2-21(16-24)29-20-5-3-18(4-6-20)25-12-14-26(15-13-25)19-7-9-23-10-8-19/h3-10,21H,1-2,11-17H2,(H,27,28)