ethyl 6-oxidanylidene-9-(phenylmethyl)-2,3-dihydro-1H-purine-2-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-9-(phenylmethyl)-2,3-dihydro-1H-purine-2-carboxylate Openeye Name: ethyl 9-benzyl-6-oxo-2,3-dihydro-1H-purine-2-carboxylate CAS Name: 6-oxo-9-(phenylmethyl)-2,3-dihydro-1H-purine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 9-benzyl-6-oxo-2,3-dihydro-1H-purine-2-carboxylate Traditional Name: 9-benzyl-6-keto-2,3-dihydro-1H-purine-2-carboxylic acid ethyl ester Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1NC2=C(C(=O)N1)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1NC2=C(C(=O)N1)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C15H16N4O3/c1-2-22-15(21)12-17-13-11(14(20)18-12)16-9-19(13)8-10-6-4-3-5-7-10/h3-7,9,12,17H,2,8H2,1H3,(H,18,20)