(2E)-9-(4-chlorophenyl)-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide

Systemtic Name: (2E)-9-(4-chlorophenyl)-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide Openeye Name: (2E)-9-(4-chlorophenyl)-2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-8-oxo-1,7-dihydropurine-6-carboxamide CAS Name: (2E)-9-(4-chlorophenyl)-2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-8-oxo-1,7-dihydropurine-6-carboxamide IUPAC Name: (2E)-9-(4-chlorophenyl)-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-8-oxo-1,7-dihydropurine-6-carboxamide Traditional Name: (2E)-9-(4-chlorophenyl)-8-keto-2-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Formula: C19H14ClN5O4 MolecularWeight: 411.79856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2NC(=C3C(=N2)N(C(=O)N3)C4=CC=C(C=C4)Cl)C(=O)N)C=CC1=O

Isomeric SMILES

COC1=C/C(=C/2\NC(=C3C(=N2)N(C(=O)N3)C4=CC=C(C=C4)Cl)C(=O)N)/C=CC1=O

InChI

InChI=1S/C19H14ClN5O4/c1-29-13-8-9(2-7-12(13)26)17-22-14(16(21)27)15-18(24-17)25(19(28)23-15)11-5-3-10(20)4-6-11/h2-8,22H,1H3,(H2,21,27)(H,23,28)/b17-9+