3-[3-formamido-6-(4-pyridin-4-ylpiperazin-1-yl)pyridin-2-yl]propanoic acid

Systemtic Name: 3-[3-formamido-6-(4-pyridin-4-ylpiperazin-1-yl)pyridin-2-yl]propanoic acid Openeye Name: 3-[3-formamido-6-[4-(4-pyridyl)piperazin-1-yl]-2-pyridyl]propanoic acid CAS Name: 3-[3-formamido-6-(4-pyridin-4-yl-1-piperazinyl)-2-pyridinyl]propanoic acid IUPAC Name: 3-[3-formamido-6-(4-pyridin-4-ylpiperazin-1-yl)pyridin-2-yl]propanoic acid Traditional Name: 3-[3-formamido-6-[4-(4-pyridyl)piperazino]-2-pyridyl]propionic acid Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C3=NC(=C(C=C3)NC=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C3=NC(=C(C=C3)NC=O)CCC(=O)O

InChI

InChI=1S/C18H21N5O3/c24-13-20-15-1-3-17(21-16(15)2-4-18(25)26)23-11-9-22(10-12-23)14-5-7-19-8-6-14/h1,3,5-8,13H,2,4,9-12H2,(H,20,24)(H,25,26)