2-(4-methoxy-3-oxidanyl-phenyl)-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-(4-methoxy-3-oxidanyl-phenyl)-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(3-hydroxy-4-methoxy-phenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(3-hydroxy-4-methoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(3-hydroxy-4-methoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(3-hydroxy-4-methoxy-phenyl)-8-keto-9-(3-methoxyphenyl)-7H-purine-6-carboxamide Formula: C20H17N5O5 MolecularWeight: 407.37948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=CC=C4)OC)C(=O)N)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC(=CC=C4)OC)C(=O)N)O

InChI

InChI=1S/C20H17N5O5/c1-29-12-5-3-4-11(9-12)25-19-16(23-20(25)28)15(17(21)27)22-18(24-19)10-6-7-14(30-2)13(26)8-10/h3-9,26H,1-2H3,(H2,21,27)(H,23,28)