2-(2-methoxyphenyl)-8-oxidanylidene-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide

Systemtic Name: 2-(2-methoxyphenyl)-8-oxidanylidene-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Openeye Name: 2-(2-methoxyphenyl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide CAS Name: 2-(2-methoxyphenyl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide IUPAC Name: 2-(2-methoxyphenyl)-8-oxo-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Traditional Name: 8-keto-2-(2-methoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-7H-purine-6-carboxamide Formula: C22H21N5O6 MolecularWeight: 451.43204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)N

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)N

InChI

InChI=1S/C22H21N5O6/c1-30-13-8-6-5-7-12(13)20-24-16(19(23)28)17-21(26-20)27(22(29)25-17)11-9-14(31-2)18(33-4)15(10-11)32-3/h5-10H,1-4H3,(H2,23,28)(H,25,29)