4-[(6-oxidanylidene-3,7-dihydropurin-2-yl)amino]butanoate

Systemtic Name: 4-[(6-oxidanylidene-3,7-dihydropurin-2-yl)amino]butanoate Openeye Name: 4-[(6-oxo-3,7-dihydropurin-2-yl)amino]butanoate CAS Name: 4-[(6-oxo-3,7-dihydropurin-2-yl)amino]butanoate IUPAC Name: 4-[(6-oxo-3,7-dihydropurin-2-yl)amino]butanoate Traditional Name: 4-[(6-keto-3,7-dihydropurin-2-yl)amino]butyrate Formula: C9H10N5O3- MolecularWeight: 236.2074

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=O)N=C(N2)NCCCC(=O)[O-]

Isomeric SMILES

C1=NC2=C(N1)C(=O)N=C(N2)NCCCC(=O)[O-]

InChI

InChI=1S/C9H11N5O3/c15-5(16)2-1-3-10-9-13-7-6(8(17)14-9)11-4-12-7/h4H,1-3H2,(H,15,16)(H3,10,11,12,13,14,17)/p-1