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

Systemtic Name: 5-(2-bromanyl-5-nitro-phenyl)-1,3-dimethyl-6-(3-methylphenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6-(m-tolyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6-(3-methylphenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6-(3-methylphenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6-(m-tolyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C21H17BrN4O4 MolecularWeight: 469.28808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C3C(=C2C4=C(C=CC(=C4)[N+](=O)[O-])Br)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C3C(=C2C4=C(C=CC(=C4)[N+](=O)[O-])Br)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C21H17BrN4O4/c1-12-5-4-6-13(9-12)25-11-17-18(20(27)24(3)21(28)23(17)2)19(25)15-10-14(26(29)30)7-8-16(15)22/h4-11H,1-3H3