9-(2,3-dimethoxyphenyl)-8-oxidanylidene-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide

Systemtic Name: 9-(2,3-dimethoxyphenyl)-8-oxidanylidene-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Openeye Name: 9-(2,3-dimethoxyphenyl)-8-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide CAS Name: 9-(2,3-dimethoxyphenyl)-8-oxo-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,7-dihydropurine-6-carboxamide IUPAC Name: 9-(2,3-dimethoxyphenyl)-8-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Traditional Name: 9-(2,3-dimethoxyphenyl)-8-keto-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Formula: C20H17N5O5 MolecularWeight: 407.37948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)N2C3=NC(=C4C=CC(=O)C=C4)NC(=C3NC2=O)C(=O)N

Isomeric SMILES

COC1=CC=CC(=C1OC)N2C3=NC(=C4C=CC(=O)C=C4)NC(=C3NC2=O)C(=O)N

InChI

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