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

Systemtic Name: 3-[(6-methoxy-9-methyl-purin-8-yl)carbonylamino]propanoic acid Openeye Name: 3-[(6-methoxy-9-methyl-purine-8-carbonyl)amino]propanoic acid CAS Name: 3-[[(6-methoxy-9-methyl-8-purinyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(6-methoxy-9-methylpurine-8-carbonyl)amino]propanoic acid Traditional Name: 3-[(6-methoxy-9-methyl-purine-8-carbonyl)amino]propionic acid Formula: C11H13N5O4 MolecularWeight: 279.25202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O4/c1-16-8-7(11(20-2)14-5-13-8)15-9(16)10(19)12-4-3-6(17)18/h5H,3-4H2,1-2H3,(H,12,19)(H,17,18)