3-[(9-methyl-6-piperidin-1-yl-purin-8-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(9-methyl-6-piperidin-1-yl-purin-8-yl)carbonylamino]propanoic acid Openeye Name: 3-[[9-methyl-6-(1-piperidyl)purine-8-carbonyl]amino]propanoic acid CAS Name: 3-[[[9-methyl-6-(1-piperidinyl)-8-purinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(9-methyl-6-piperidin-1-ylpurine-8-carbonyl)amino]propanoic acid Traditional Name: 3-[(9-methyl-6-piperidino-purine-8-carbonyl)amino]propionic acid Formula: C15H20N6O3 MolecularWeight: 332.3577

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC=N2)N3CCCCC3)N=C1C(=O)NCCC(=O)O

Isomeric SMILES

CN1C2=C(C(=NC=N2)N3CCCCC3)N=C1C(=O)NCCC(=O)O

InChI

InChI=1S/C15H20N6O3/c1-20-12-11(19-14(20)15(24)16-6-5-10(22)23)13(18-9-17-12)21-7-3-2-4-8-21/h9H,2-8H2,1H3,(H,16,24)(H,22,23)