(3R)-3-methyl-4-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoic acid hydrochloride

Systemtic Name: (3R)-3-methyl-4-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoic acid hydrochloride Openeye Name: (3R)-3-methyl-4-[4-[4-(4-pyridyl)piperazin-1-yl]phenoxy]butanoic acid hydrochloride CAS Name: (3R)-3-methyl-4-[4-(4-pyridin-4-yl-1-piperazinyl)phenoxy]butanoic acid hydrochloride IUPAC Name: (3R)-3-methyl-4-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]butanoic acid hydrochloride Traditional Name: (3R)-3-methyl-4-[4-[4-(4-pyridyl)piperazino]phenoxy]butyric acid hydrochloride Formula: C20H26ClN3O3 MolecularWeight: 391.89174

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)COC1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3.Cl

Isomeric SMILES

C[C@H](CC(=O)O)COC1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3.Cl

InChI

InChI=1S/C20H25N3O3.ClH/c1-16(14-20(24)25)15-26-19-4-2-17(3-5-19)22-10-12-23(13-11-22)18-6-8-21-9-7-18;/h2-9,16H,10-15H2,1H3,(H,24,25);1H/t16-;/m1./s1