3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid Openeye Name: 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid CAS Name: 3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-furancarboxylic acid IUPAC Name: 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid Traditional Name: 3-[[4-(2-pyrimidyl)piperazino]methyl]-2-furoic acid Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(OC=C2)C(=O)O)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CC2=C(OC=C2)C(=O)O)C3=NC=CC=N3

InChI

InChI=1S/C14H16N4O3/c19-13(20)12-11(2-9-21-12)10-17-5-7-18(8-6-17)14-15-3-1-4-16-14/h1-4,9H,5-8,10H2,(H,19,20)