3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(4-pyridylmethyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(pyridin-4-ylmethyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(4-pyridylmethyl)piperazino]propionic acid Formula: C13H19N3O2 MolecularWeight: 249.30886

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)CC2=CC=NC=C2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)CC2=CC=NC=C2

InChI

InChI=1S/C13H19N3O2/c17-13(18)3-6-15-7-9-16(10-8-15)11-12-1-4-14-5-2-12/h1-2,4-5H,3,6-11H2,(H,17,18)