2-[(2-acetamido-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl propanoate

Systemtic Name: 2-[(2-acetamido-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl propanoate Openeye Name: 2-[(2-acetamido-6-oxo-3H-purin-9-yl)methoxy]ethyl propanoate CAS Name: propanoic acid 2-[(2-acetamido-6-oxo-3H-purin-9-yl)methoxy]ethyl ester IUPAC Name: 2-[(2-acetamido-6-oxo-3H-purin-9-yl)methoxy]ethyl propanoate Traditional Name: propionic acid 2-[(2-acetamido-6-keto-3H-purin-9-yl)methoxy]ethyl ester Formula: C13H17N5O5 MolecularWeight: 323.30458

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCCOCN1C=NC2=C1NC(=NC2=O)NC(=O)C

Isomeric SMILES

CCC(=O)OCCOCN1C=NC2=C1NC(=NC2=O)NC(=O)C

InChI

InChI=1S/C13H17N5O5/c1-3-9(20)23-5-4-22-7-18-6-14-10-11(18)16-13(15-8(2)19)17-12(10)21/h6H,3-5,7H2,1-2H3,(H2,15,16,17,19,21)