2-[[3,7-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]amino]ethanoic acid

Systemtic Name: 2-[[3,7-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]amino]ethanoic acid Openeye Name: 2-[(3,7-dimethyl-2,6-dioxo-purin-8-yl)amino]acetic acid CAS Name: 2-[(3,7-dimethyl-2,6-dioxo-8-purinyl)amino]acetic acid IUPAC Name: 2-[(3,7-dimethyl-2,6-dioxopurin-8-yl)amino]acetic acid Traditional Name: 2-[(2,6-diketo-3,7-dimethyl-purin-8-yl)amino]acetic acid Formula: C9H11N5O4 MolecularWeight: 253.21474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NCC(=O)O)N(C(=O)NC2=O)C

Isomeric SMILES

CN1C2=C(N=C1NCC(=O)O)N(C(=O)NC2=O)C

InChI

InChI=1S/C9H11N5O4/c1-13-5-6(11-8(13)10-3-4(15)16)14(2)9(18)12-7(5)17/h3H2,1-2H3,(H,10,11)(H,15,16)(H,12,17,18)