2-(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-9-(4-ethoxyphenyl)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide

Systemtic Name: 2-(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-9-(4-ethoxyphenyl)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide Openeye Name: 2-(5-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-9-(4-ethoxyphenyl)-8-oxo-1,7-dihydropurine-6-carboxamide CAS Name: 2-(5-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-9-(4-ethoxyphenyl)-8-oxo-1,7-dihydropurine-6-carboxamide IUPAC Name: 2-(5-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-9-(4-ethoxyphenyl)-8-oxo-1,7-dihydropurine-6-carboxamide Traditional Name: 2-(5-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-8-keto-9-p-phenetyl-1,7-dihydropurine-6-carboxamide Formula: C22H21N5O5 MolecularWeight: 435.43264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=NC(=C4C=CC=C(C4=O)OCC)NC(=C3NC2=O)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=NC(=C4C=CC=C(C4=O)OCC)NC(=C3NC2=O)C(=O)N

InChI

InChI=1S/C22H21N5O5/c1-3-31-13-10-8-12(9-11-13)27-21-17(25-22(27)30)16(19(23)29)24-20(26-21)14-6-5-7-15(18(14)28)32-4-2/h5-11,24H,3-4H2,1-2H3,(H2,23,29)(H,25,30)