(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methyl propanoate

Systemtic Name: (2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methyl propanoate Openeye Name: (2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methyl propanoate CAS Name: propanoic acid (2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methyl ester IUPAC Name: (2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methyl propanoate Traditional Name: propionic acid (2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)methyl ester Formula: C9H13N5O3 MolecularWeight: 239.23122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCN1CNC2=C1NC(=NC2=O)N

Isomeric SMILES

CCC(=O)OCN1CNC2=C1NC(=NC2=O)N

InChI

InChI=1S/C9H13N5O3/c1-2-5(15)17-4-14-3-11-6-7(14)12-9(10)13-8(6)16/h11H,2-4H2,1H3,(H3,10,12,13,16)