[3-methyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)purin-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [3-methyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)purin-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: (7-benzyl-3-methyl-2,6-dioxo-purin-1-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-methyl-2,6-dioxo-7-(phenylmethyl)-1-purinyl]methyl ester IUPAC Name: (7-benzyl-3-methyl-2,6-dioxopurin-1-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (7-benzyl-2,6-diketo-3-methyl-purin-1-yl)methyl ester Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N(C1=O)C

Isomeric SMILES

CC(C)(C)C(=O)OCN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N(C1=O)C

InChI

InChI=1S/C19H22N4O4/c1-19(2,3)17(25)27-12-23-16(24)14-15(21(4)18(23)26)20-11-22(14)10-13-8-6-5-7-9-13/h5-9,11H,10,12H2,1-4H3