3-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]propionic acid Formula: C13H18N6O2 MolecularWeight: 290.32102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CCC(=O)O

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CCC(=O)O

InChI

InChI=1S/C13H18N6O2/c1-17-12-10(8-16-17)13(15-9-14-12)19-6-4-18(5-7-19)3-2-11(20)21/h8-9H,2-7H2,1H3,(H,20,21)