6-(2-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitro-phenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 6-(2-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitro-phenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 6-(2-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitro-phenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 6-(2-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 6-(2-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 6-(2-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitro-phenyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C3C(=CN2C4=CC=CC=C4O)N(C(=O)N(C3=O)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C3C(=CN2C4=CC=CC=C4O)N(C(=O)N(C3=O)C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O5/c1-12-8-9-13(10-15(12)25(29)30)19-18-16(22(2)21(28)23(3)20(18)27)11-24(19)14-6-4-5-7-17(14)26/h4-11,26H,1-3H3