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

Systemtic Name: 3-[(6-chloranyl-9-methyl-purin-8-yl)carbonylamino]propanoic acid Openeye Name: 3-[(6-chloro-9-methyl-purine-8-carbonyl)amino]propanoic acid CAS Name: 3-[[(6-chloro-9-methyl-8-purinyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(6-chloro-9-methylpurine-8-carbonyl)amino]propanoic acid Traditional Name: 3-[(6-chloro-9-methyl-purine-8-carbonyl)amino]propionic acid Formula: C10H10ClN5O3 MolecularWeight: 283.6711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN5O3/c1-16-8-6(7(11)13-4-14-8)15-9(16)10(19)12-3-2-5(17)18/h4H,2-3H2,1H3,(H,12,19)(H,17,18)