5-(4-hydroxyphenyl)-6-(3-methoxy-4-oxidanyl-phenyl)carbonyl-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-(4-hydroxyphenyl)-6-(3-methoxy-4-oxidanyl-phenyl)carbonyl-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione Openeye Name: 6-(4-hydroxy-3-methoxy-benzoyl)-5-(4-hydroxyphenyl)-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione CAS Name: 6-[(4-hydroxy-3-methoxyphenyl)-oxomethyl]-5-(4-hydroxyphenyl)-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione IUPAC Name: 6-(4-hydroxy-3-methoxybenzoyl)-5-(4-hydroxyphenyl)-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-(4-hydroxyphenyl)-6-vanilloyl-1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-quinone Formula: C20H15N3O6 MolecularWeight: 393.3496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C2=C(C3=C(N2)NC(=O)NC3=O)C4=CC=C(C=C4)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)C2=C(C3=C(N2)NC(=O)NC3=O)C4=CC=C(C=C4)O)O

InChI

InChI=1S/C20H15N3O6/c1-29-13-8-10(4-7-12(13)25)17(26)16-14(9-2-5-11(24)6-3-9)15-18(21-16)22-20(28)23-19(15)27/h2-8,24-25H,1H3,(H3,21,22,23,27,28)