(phenylmethyl) N-(6-oxidanylidene-3,7-dihydropurin-2-yl)carbamate

Systemtic Name: (phenylmethyl) N-(6-oxidanylidene-3,7-dihydropurin-2-yl)carbamate Openeye Name: benzyl N-(6-oxo-3,7-dihydropurin-2-yl)carbamate CAS Name: N-(6-oxo-3,7-dihydropurin-2-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(6-oxo-3,7-dihydropurin-2-yl)carbamate Traditional Name: N-(6-keto-3,7-dihydropurin-2-yl)carbamic acid benzyl ester Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=NC(=O)C3=C(N2)N=CN3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=NC(=O)C3=C(N2)N=CN3

InChI

InChI=1S/C13H11N5O3/c19-11-9-10(15-7-14-9)16-12(17-11)18-13(20)21-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,14,15,16,17,18,19,20)