6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-3-carboxylic acid

Systemtic Name: 6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-3-carboxylic acid Openeye Name: 6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-3-carboxylic acid CAS Name: 6-[4-(2-pyrimidinyl)-1-piperazinyl]-3-pyridinecarboxylic acid IUPAC Name: 6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-3-carboxylic acid Traditional Name: 6-[4-(2-pyrimidyl)piperazino]nicotinic acid Formula: C14H15N5O2 MolecularWeight: 285.3012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(=O)O)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(=O)O)C3=NC=CC=N3

InChI

InChI=1S/C14H15N5O2/c20-13(21)11-2-3-12(17-10-11)18-6-8-19(9-7-18)14-15-4-1-5-16-14/h1-5,10H,6-9H2,(H,20,21)