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

Systemtic Name: 3-[(9-methyl-6-oxidanylidene-3H-purin-8-yl)carbonylamino]propanoic acid Openeye Name: 3-[(9-methyl-6-oxo-3H-purine-8-carbonyl)amino]propanoic acid CAS Name: 3-[[(9-methyl-6-oxo-3H-purin-8-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(9-methyl-6-oxo-3H-purine-8-carbonyl)amino]propanoic acid Traditional Name: 3-[(6-keto-9-methyl-3H-purine-8-carbonyl)amino]propionic acid Formula: C10H11N5O4 MolecularWeight: 265.22544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N=CN2)N=C1C(=O)NCCC(=O)O

Isomeric SMILES

CN1C2=C(C(=O)N=CN2)N=C1C(=O)NCCC(=O)O

InChI

InChI=1S/C10H11N5O4/c1-15-7-6(9(18)13-4-12-7)14-8(15)10(19)11-3-2-5(16)17/h4H,2-3H2,1H3,(H,11,19)(H,16,17)(H,12,13,18)