3-(4-pyridin-4-ylpiperazin-1-yl)propanoate

Systemtic Name: 3-(4-pyridin-4-ylpiperazin-1-yl)propanoate Openeye Name: 3-[4-(4-pyridyl)piperazin-1-yl]propanoate CAS Name: 3-(4-pyridin-4-yl-1-piperazinyl)propanoate IUPAC Name: 3-(4-pyridin-4-ylpiperazin-1-yl)propanoate Traditional Name: 3-[4-(4-pyridyl)piperazino]propionate Formula: C12H16N3O2- MolecularWeight: 234.27434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)[O-])C2=CC=NC=C2

Isomeric SMILES

C1CN(CCN1CCC(=O)[O-])C2=CC=NC=C2

InChI

InChI=1S/C12H17N3O2/c16-12(17)3-6-14-7-9-15(10-8-14)11-1-4-13-5-2-11/h1-2,4-5H,3,6-10H2,(H,16,17)/p-1