1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]ethyl benzoate

Systemtic Name: 1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]ethyl benzoate Openeye Name: 1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]ethyl benzoate CAS Name: benzoic acid 1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]ethyl ester IUPAC Name: 1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]ethyl benzoate Traditional Name: benzoic acid 1-[(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)methoxy]ethyl ester Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

CC(OCN1CNC2=C1NC(=NC2=O)N)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(OCN1CNC2=C1NC(=NC2=O)N)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H17N5O4/c1-9(24-14(22)10-5-3-2-4-6-10)23-8-20-7-17-11-12(20)18-15(16)19-13(11)21/h2-6,9,17H,7-8H2,1H3,(H3,16,18,19,21)