propyl 1,8-dimethyl-3-(2-methylbutyl)-2,6-bis(oxidanylidene)purine-7-carboxylate

Systemtic Name: propyl 1,8-dimethyl-3-(2-methylbutyl)-2,6-bis(oxidanylidene)purine-7-carboxylate Openeye Name: propyl 1,8-dimethyl-3-(2-methylbutyl)-2,6-dioxo-purine-7-carboxylate CAS Name: 1,8-dimethyl-3-(2-methylbutyl)-2,6-dioxo-7-purinecarboxylic acid propyl ester IUPAC Name: propyl 1,8-dimethyl-3-(2-methylbutyl)-2,6-dioxopurine-7-carboxylate Traditional Name: 2,6-diketo-1,8-dimethyl-3-(2-methylbutyl)purine-7-carboxylic acid propyl ester Formula: C16H24N4O4 MolecularWeight: 336.38616

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)N1C(=NC2=C1C(=O)N(C(=O)N2CC(C)CC)C)C

Isomeric SMILES

CCCOC(=O)N1C(=NC2=C1C(=O)N(C(=O)N2CC(C)CC)C)C

InChI

InChI=1S/C16H24N4O4/c1-6-8-24-16(23)20-11(4)17-13-12(20)14(21)18(5)15(22)19(13)9-10(3)7-2/h10H,6-9H2,1-5H3